SMILES for Non-receptor tyrosine-protein kinase TYK2

6426 SMILES Strings for Non-receptor tyrosine-protein kinase TYK2

Compound Name

SMILES String

BDBM31085

CCN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4cc(NC)ncn4)cc3)cc2C(F)(F)F)CC1

BDBM50193995

C[C@@H]1CCN(C[C@@H]1N(C)c1ncnc2[nH]ccc12)C(=O)CC#N |r|

BDBM6866

c1cc(c(c(c1)F)C(=O)n2c(nc(n2)Nc3ccc(cc3)S(=O)(=O)N)N)F

BDBM31094

[H][C@@]12C[C@@H]([C@H](OC)[C@@](C)(O1)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13)N(C)C(=O)c1ccccc1 |TLB:11:10:9:4.3.2,17:33:9:4.3.2,THB:24:32:9:4.3.2,5:4:9:10.31.33.32,30:31:9:4.3.2|

BDBM31095

Cc1[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1

BDBM31096

CN[C@H]1C[C@@H]2O[C@](C)([C@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13

BDBM4814

CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C

BDBM81442

C[C@@H]1CCC(CC1N(C)c1ncnc2[nH]ccc12)C(=O)CC#N |r|

BDBM26198

CC(C)(C)c1nc2c([nH]1)c1ccc(F)cc1c1c2cc[nH]c1=O

BDBM50335231

CC(C)(O)C(=O)N1CCN(CC1)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)C(F)(F)F |t:20|

BDBM50237710

Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)cc(c1)C(F)(F)F

BDBM13530

CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1

BDBM103727

O=C(Nc1nc2cccc(-c3ccc(CN4CCS(=O)(=O)CC4)cc3)n2n1)C1CC1

BDBM103728

O=C(Nc1nc2cccc(-c3ccc(CN4CCOCC4)cc3)n2n1)C1CC1

BDBM103737

FC1(F)CCN(Cc2ccc(cc2)-c2cccc3nc(NC(=O)C4CC4)nn23)CC1

BDBM67818

ClCC(=O)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107118

CN(C)CC(=O)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107119

O=C(CN1CCCC1)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107120

Clc1ccc(cc1)N1CCN(CC(=O)Nc2cccc(c2)-c2cnc3ccccc3n2)CC1

BDBM107121

ClCCCC(=O)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107122

CCC(=O)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107123

O=C(Cn1cncn1)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107124

O=C(CC#N)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107125

O=C(CN1CCCCC1)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107126

COc1ccc(NC(=O)Nc2cccc(c2)-c2cnc3ccccc3n2)cc1

BDBM67663

CNC(=S)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107127

O=C(Nc1cccc(c1)-c1cnc2ccccc2n1)c1ccco1

BDBM107128

O=S(=O)(Nc1cccc(c1)-c1cnc2ccccc2n1)c1cccs1

BDBM107129

O=C(Nc1cccc(c1)-c1cnc2ccccc2n1)C1CC1

BDBM107130

CS(=O)(=O)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107131

O=C(CN1CCN(CC1)c1ccccc1)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107132

CN1CCN(CC(=O)Nc2cccc(c2)-c2cnc3ccccc3n2)CC1

BDBM107133

ClC(Cl)C(=O)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107134

ClCCC(=O)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107135

O=C(CN1CCOCC1)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107136

CC(Cl)C(=O)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107137

C=CC(=O)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107138

C=CCC(=O)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107139

BrCC(=O)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107140

CSCC(=O)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107141

FC(F)(F)C(=O)CC(=O)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107142

CS(=O)(=O)OCC(=O)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107143

CC(=O)OCC(=O)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107144

OCC(=O)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107145

CC(=O)SCC(=O)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107146

CC(Nc1cccc(c1)-c1cnc2ccccc2n1)=C1CCOC1=O |w:1.0|

BDBM107147

CCOC(=O)CC(=O)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107148

O=C(CN1CCN(CC1)c1ccncc1)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107149

OC1CCN(CC(=O)Nc2cccc(c2)-c2cnc3ccccc3n2)CC1

BDBM107150

O=C(CN1CCNCC1)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM107151

NS(=O)(=O)CCC(=O)Nc1cccc(c1)-c1cnc2ccccc2n1

BDBM50399016

Cc1ccc(C)c(c1)-c1nn(C)cc1NC(=O)c1cnn2ccc(N)nc12

BDBM116312

Cc1cc(NC(=O)c2cnn3ccc(N)nc23)n(n1)-c1cc(Cl)ccc1C

BDBM116313

Cc1nc(c(NC(=O)c2cnn3ccc(N)nc23)s1)-c1ccccc1C

BDBM116314

Cc1cc(NC(=O)c2cnn3ccc(Nc4cccc(c4)C(F)(F)F)nc23)on1

BDBM116315

Nc1ccn2ncc(C(=O)Nc3c[nH]nc3-c3cc(Cl)ccc3Cl)c2n1

BDBM50399031

Nc1ccn2ncc(C(=O)Nc3conc3-c3cccc(Cl)c3)c2n1

BDBM116316

Nc1ccn2ncc(C(=O)Nc3ccnn3-c3cc(Cl)ccc3Cl)c2n1

BDBM116317

O=C(NC1CCOCC1)c1cnn2ccc(NC3Cc4ccccc4C3)nc12

BDBM116318

O[C@H]1CCC(CC1)NC(=O)c1cnn2ccc(NC3CCc4ccccc34)nc12 |r,wU:1.0,(-2.56,-5.93,;-2.16,-4.44,;-3.25,-3.35,;-2.85,-1.87,;-1.36,-1.47,;-.27,-2.56,;-.67,-4.04,;-.96,.02,;-2.05,1.11,;-3.54,.71,;-1.66,2.6,;-2.56,3.84,;-1.66,5.09,;-.19,4.61,;1.14,5.38,;2.48,4.61,;2.48,3.07,;3.81,2.3,;3.81,.76,;2.56,-.14,;3.04,-1.61,;4.58,-1.61,;5.67,-2.7,;7.16,-2.3,;7.56,-.81,;6.47,.28,;5.06,-.14,;1.14,2.3,;-.19,3.07,)|

BDBM116319

Cc1cc(NC(=O)c2cnn3ccc(N)nc23)n(n1)-c1ccccc1C

BDBM120128

Clc1cccc(Cl)c1-c1nc2ccnc(NC(=O)C3CC3)c2s1

BDBM120129

COC(=O)Nc1nccc2nc(sc12)-c1c(Cl)cccc1Cl

BDBM120130

OCC(=O)Nc1nccc2nc(sc12)-c1c(Cl)cccc1Cl

BDBM120131

Fc1cccc(Cl)c1-c1nc2ccnc(NC(=O)NC3CC3)c2s1

BDBM120132

OCc1ccnc(Nc2nccc3nc(sc23)-c2c(Cl)cccc2Cl)c1

BDBM120133

Cc1cc(Nc2nccc3nc(sc23)-c2c(Cl)cc(CO)cc2Cl)ncn1

BDBM120134

Clc1cccc(Cl)c1-c1nc2ncnc(NC(=O)C3CC3)c2s1

BDBM120135

OC1CN(C1)c1cc(Nc2ncnc3nc(sc23)-c2c(Cl)cccc2Cl)ncn1

BDBM120136

Cc1cc(Nc2nccc3nc(sc23)-c2ccccc2Cl)nc(C)n1

BDBM120137

CCc1cc(Nc2nccc3nc(sc23)-c2c(Cl)cc(cc2Cl)C(N)=O)ncn1

BDBM120138

Cc1cc(Nc2nccc3nc(sc23)-c2c(Cl)cc(cc2Cl)C2CC2)ncn1

BDBM120139

Fc1cnc(NC(=O)C2CC2)c2sc(nc12)-c1c(Cl)cc(cc1Cl)C#N

BDBM120140

Nc1cc(Nc2ncc(C#N)c3nc(sc23)-c2c(F)cccc2Cl)ncn1

BDBM120141

Nc1cc(Nc2ncc(C#N)c3nc(sc23)-c2c(F)cccc2[N+]#[C-])ncn1

BDBM120142

Cc1cc(Nc2nccc3nc(sc23)-c2c(cc(cc2[N+]#[C-])C#N)[N+]#[C-])nc(C)n1

BDBM120143

Cc1nc(CO)cc(Nc2nccc3nc(sc23)-c2c(Cl)cccc2[N+]#[C-])n1

BDBM125898

Clc1cnc2Nc3cccc(COc4cccc(CNc1n2)c4)c3

BDBM125899

Clc1cnc2Nc3cccc(CCOc4cccc(CNc1n2)c4)c3

BDBM125900

Clc1cnc2Nc3cccc(c3)S(=O)(=O)Nc3cccc(CNc1n2)c3

BDBM125901

Clc1cnc2Nc3cccc(c3)C(=O)Nc3cccc(CNc1n2)c3

BDBM125902

Clc1cnc2Nc3cccc(CCCOc4cccc(CNc1n2)c4)c3

BDBM125903

C[C@H]1Nc2nc(Nc3cccc(COc4cccc1c4)c3)ncc2Cl |r|

BDBM125904

Clc1cnc2Nc3cccc(OCCOc4cccc(CNc1n2)c4)c3

BDBM125905

Clc1cnc2Nc3cccc(COc4cccc(CCNc1n2)c4)c3

BDBM125906

Clc1cnc2Nc3cccc(CCOc4cccc(CCNc1n2)c4)c3

BDBM125907

Clc1cnc2Nc3cccc(COc4cccc(CCCNc1n2)c4)c3

BDBM125908

C[C@@H]1Nc2nc(Nc3cccc(COc4cccc1c4)c3)ncc2Cl |r|

BDBM125909

Clc1cnc2Nc3cccc(CCCOc4cccc(CCNc1n2)c4)c3

BDBM125910

Clc1cnc2Nc3cccc(CCOc4cccc(CCCNc1n2)c4)c3

BDBM125911

Clc1cnc2Nc3cccc(CCCOc4ccc(Br)c(CNc1n2)c4)c3

BDBM125912

Clc1cnc2Nc3cccc(CCCOc4ccc(c(CNc1n2)c4)-c1ccccc1)c3

BDBM125913

Clc1cnc2Nc3cccc(CCCOc4cc(Br)cc(CNc1n2)c4)c3

BDBM125914

Nc1ccc2CNc3nc(Nc4cncc(CCc1c2)c4)ncc3Cl

BDBM125915

Clc1cnc2Nc3cncc(CCc4cc(CNc1n2)ccc4NC(=O)c1ccccc1)c3

BDBM125916

Clc1cnc2Nc3cncc(CCc4cc(CNc1n2)ccc4NS(=O)(=O)c1ccccc1C#N)c3

BDBM127657

NC(=O)c1cnn2ccc(nc12)N1CCC[C@@H]1c1cc(F)ccc1F |r|

BDBM127679

Fc1cncc(c1)[C@H]1CCCN1c1ccn2ncc(C(=O)NC3CC3)c2n1 |r|

BDBM127767

COc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC3CC[C@H](O)CC3)c2n1 |r,wD:9.9,27.29,(-7.78,2.63,;-6.29,2.23,;-5.21,3.32,;-5.6,4.81,;-4.51,5.9,;-3.03,5.5,;-1.94,6.59,;-2.63,4.01,;-3.72,2.92,;-3.32,1.43,;-4.22,.19,;-3.32,-1.06,;-1.85,-.58,;-1.85,.96,;-.52,1.73,;-.52,3.27,;.81,4.04,;2.15,3.27,;3.61,3.74,;4.52,2.5,;3.61,1.25,;4.01,-.24,;2.92,-1.33,;5.5,-.64,;5.9,-2.12,;7.38,-2.52,;7.78,-4.01,;6.69,-5.1,;7.09,-6.59,;5.21,-4.7,;4.81,-3.21,;2.15,1.73,;.81,.96,)|

BDBM127720

CC(C)NC(=O)c1cnn2ccc(nc12)N1CCC[C@@H]1c1cncc(F)c1 |r|

BDBM127733

Fc1cncc(c1)C1CCCN1c1ccn2ncc(C(=O)NCC3CC3)c2n1

BDBM127741

CNC(=O)c1cnn2ccc(nc12)N1CCCC1c1cncc(F)c1

BDBM127808

Cc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC3CC3)c2n1 |r|

BDBM127718

CC1(CC1)NC(=O)c1cnn2ccc(nc12)N1CCC[C@@H]1c1cncc(F)c1 |r|

BDBM127750

C[C@@H](NC(=O)c1cnn2ccc(nc12)N1CCC[C@@H]1c1cncc(F)c1)C1CC1 |r|

BDBM127751

C[C@H](NC(=O)c1cnn2ccc(nc12)N1CCC[C@@H]1c1cncc(F)c1)C1CC1 |r|

BDBM127817

Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)NC3(C)CC3)c2n1

BDBM127725

Fc1cncc(c1)[C@H]1CCCN1c1ccn2ncc(C(=O)NC3(CC3)C(F)(F)F)c2n1 |r|

BDBM127821

Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)NC3CC[C@H](O)CC3)c2n1 |r,wD:26.28,(-7.38,2.87,;-6.05,3.64,;-6.05,5.18,;-4.72,5.95,;-3.38,5.18,;-2.05,5.95,;-3.38,3.64,;-4.72,2.87,;-4.72,1.33,;-5.96,.42,;-5.49,-1.04,;-3.95,-1.04,;-3.47,.42,;-2.14,1.19,;-2.14,2.73,;-.8,3.5,;.53,2.73,;1.99,3.21,;2.9,1.96,;1.99,.72,;2.76,-.62,;1.99,-1.95,;4.3,-.62,;5.07,-1.95,;6.61,-1.95,;7.38,-3.28,;6.61,-4.62,;7.38,-5.95,;5.07,-4.62,;4.3,-3.28,;.53,1.19,;-.8,.42,)|

BDBM153662

Fc1cccc(c1)-c1cnccc1NC(=O)c1cnn2cccnc12

BDBM153656

Cc1cc(NC(=O)c2cnn3cccnc23)n(n1)-c1cc(Cl)ccc1C

BDBM153668

Clc1ccc(=O)n(c1)-c1n[nH]cc1NC(=O)c1cnn2cccnc12

BDBM153659

Cc1cc(NC(=O)c2cnn3cccnc23)n(n1)-c1ccccc1Br

BDBM153669

COc1ccc(Cl)cc1-c1c(NC(=O)c2c(N)nn3cccnc23)cnn1CC(N)=O |(1.54,-5.36,;.77,-4.03,;1.54,-2.7,;3.08,-2.7,;3.85,-1.36,;3.08,-.03,;3.85,1.31,;1.54,-.03,;.77,-1.36,;-.77,-1.36,;-1.67,-.12,;-.9,1.22,;-1.67,2.55,;-3.16,2.15,;-.9,3.89,;-1.81,5.13,;-3.35,5.13,;-.9,6.38,;.56,5.9,;1.89,6.67,;3.23,5.9,;3.23,4.36,;1.89,3.59,;.56,4.36,;-3.14,-.59,;-3.14,-2.13,;-1.67,-2.61,;-1.28,-4.09,;-2.36,-5.18,;-1.97,-6.67,;-3.85,-4.79,)|

BDBM153674

CC1CCCCN1c1nn(CC(C)(C)O)cc1NC(=O)c1cnn2cccnc12

BDBM153666

COc1ncc(cc1-c1n[nH]cc1NC(=O)c1cnn2cccnc12)C#N

BDBM153665

COc1ccc(cc1-c1nn(Cc2nncn2C)cc1NC(=O)c1cnn2cccnc12)C#N

BDBM153673

COc1ccc(F)cc1-c1nn(CC2(O)CCOCC2)cc1NC(=O)c1cnn2cccnc12

BDBM153670

COc1ccc(Cl)cc1-c1nn(CC(=O)N2CCCC2C)cc1NC(=O)c1cnn2cccnc12

BDBM153672

COc1ccc(cc1-c1nn(CC2(O)CCCC2)cc1NC(=O)c1cnn2cccnc12)C#N

BDBM153677

COc1ccc(Cl)cc1-c1nn(CC(O)(C(F)(F)F)C(F)(F)F)cc1NC(=O)c1cnn2cccnc12

BDBM153671

COc1ccc(Cl)cc1-c1nn(CC(=O)N2CCC=CC2)cc1NC(=O)c1cnn2cccnc12 |c:19|

BDBM153667

COc1ccc(Cl)cc1-c1nc(C)sc1NC(=O)c1cnn2cccnc12

BDBM153678

COc1ncc(Cl)cc1-c1nn(CC(=O)N(C)C)cc1NC(=O)c1cnn2cccnc12

BDBM153676

CCOc1ccc(Cl)cc1-c1nn(cc1NC(=O)c1cnn2cccnc12)[C@H]1CCCC[C@@H]1O |r|

BDBM153664

COc1cnc(cc1-c1nn(CC(C)(C)O)cc1NC(=O)c1cnn2cccnc12)C(F)(F)F

BDBM153658

Cc1cc(NC(=O)c2cnn3cccnc23)n(n1)-c1cc(Cl)ccc1Cl

BDBM153657

Cc1cc(NC(=O)c2cnn3cccnc23)n(n1)-c1cc(ccc1C)C#N

BDBM50399021

Cn1cc(NC(=O)c2cnn3cccnc23)c(n1)-c1cc(Cl)ccc1Cl

BDBM153660

Clc1ccccc1-n1nccc1NC(=O)c1cnn2cccnc12

BDBM153661

Clc1ccc(cc1)-n1nccc1NC(=O)c1cnn2cccnc12

BDBM153663

COc1ccc(Cl)cc1-c1c(NC(=O)c2cnn3cccnc23)cnn1CCO |(1.2,-5.39,;.43,-4.06,;1.2,-2.73,;2.74,-2.73,;3.51,-1.39,;2.74,-.06,;3.51,1.27,;1.2,-.06,;.43,-1.39,;-1.11,-1.39,;-2.02,-.15,;-1.25,1.19,;-2.02,2.52,;-3.51,2.12,;-1.25,3.85,;-2.15,5.1,;-1.25,6.35,;.22,5.87,;1.55,6.64,;2.88,5.87,;2.88,4.33,;1.55,3.56,;.22,4.33,;-3.48,-.62,;-3.48,-2.16,;-2.02,-2.64,;-1.25,-3.97,;-2.02,-5.31,;-1.25,-6.64,)|

BDBM153675

O=C(Nc1c[nH]nc1N1CCC(CC1)C#N)c1cnn2cccnc12

BDBM159747

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)CC(F)(F)F)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(-5.61,1.48,;-4.28,.71,;-2.94,1.48,;-2.55,2.97,;-1.06,2.57,;-1.46,1.09,;.28,3.34,;1.61,2.57,;.84,1.24,;2.38,1.24,;2.94,3.34,;4.28,2.57,;5.61,1.8,;5.05,3.91,;3.51,1.24,;-4.28,-.83,;-5.61,-1.6,;-5.61,-3.14,;-4.28,-3.91,;-2.94,-3.14,;-1.48,-3.61,;-.57,-2.37,;-1.48,-1.12,;-2.94,-1.6,)|

BDBM159748

CCCS(=O)(=O)NC1CC(C1)N(C)c2c3cc[nH]c3ncn2

BDBM159749

CC(C)CS(=O)(=O)N[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:10.12,8.7,(5.44,2.67,;3.95,2.27,;3.55,.79,;2.86,3.36,;1.37,2.96,;1.37,4.5,;-.11,3.36,;.97,1.48,;-.51,1.08,;-1.85,1.85,;-2.62,.51,;-1.28,-.26,;-4.1,.12,;-5.19,1.2,;-4.1,-1.42,;-5.44,-2.19,;-5.44,-3.73,;-4.1,-4.5,;-2.77,-3.73,;-1.31,-4.21,;-.4,-2.96,;-1.31,-1.72,;-2.77,-2.19,)|

BDBM159750

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)[C@H]1C[C@H](CC#N)C1)c1ncnc2[nH]ccc12 |r,wU:10.10,wD:2.1,4.6,12.13,(-5.36,3.28,;-4.28,2.19,;-2.79,2.59,;-2.02,3.92,;-.68,3.15,;-1.45,1.82,;.8,3.55,;1.89,2.46,;3.38,2.86,;1.49,.97,;2.98,1.37,;4.52,1.37,;4.52,-.17,;5.61,-1.26,;4.84,-2.59,;4.07,-3.92,;2.98,-.17,;-4.28,.65,;-5.61,-.12,;-5.61,-1.66,;-4.28,-2.43,;-2.94,-1.66,;-1.48,-2.14,;-.57,-.89,;-1.48,.36,;-2.94,-.12,)|

BDBM159751

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)[C@@H]1C[C@H](CC#N)C1)c1ncnc2[nH]ccc12 |r,wU:10.10,12.13,wD:2.1,4.6,(-5.89,1.48,;-4.55,.71,;-3.22,1.48,;-2.82,2.97,;-1.33,2.57,;-1.73,1.09,;,3.34,;1.33,2.57,;.56,1.24,;2.1,3.91,;2.67,1.8,;3.07,.32,;4.55,.71,;5.89,-.06,;5.89,-1.6,;5.89,-3.14,;4.15,2.2,;-4.55,-.83,;-5.89,-1.6,;-5.89,-3.14,;-4.55,-3.91,;-3.22,-3.14,;-1.76,-3.61,;-.85,-2.37,;-1.76,-1.12,;-3.22,-1.6,)|

BDBM159752

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)CC1(CC#N)COC1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(-6.26,.84,;-4.93,.07,;-3.59,.84,;-3.59,2.38,;-2.05,2.38,;-2.05,.84,;-.96,3.47,;.52,3.07,;.92,4.55,;.13,1.58,;2.01,2.67,;2.41,1.18,;3.18,2.51,;4.72,2.51,;6.26,2.51,;1.32,.09,;2.41,-1,;3.5,.09,;-4.93,-1.47,;-6.26,-2.24,;-6.26,-3.78,;-4.93,-4.55,;-3.59,-3.78,;-2.13,-4.26,;-1.22,-3.01,;-2.13,-1.77,;-3.59,-2.24,)|

BDBM159753

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)CC1COC1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(-5.89,1.77,;-4.55,1,;-3.22,1.77,;-2.82,3.25,;-1.33,2.85,;-1.73,1.37,;,3.62,;1.33,2.85,;.24,1.77,;2.42,1.77,;2.67,3.62,;4,2.85,;4.4,1.37,;5.89,1.77,;5.49,3.25,;-4.55,-.54,;-5.89,-1.31,;-5.89,-2.85,;-4.55,-3.62,;-3.22,-2.85,;-1.76,-3.33,;-.85,-2.08,;-1.76,-.84,;-3.22,-1.31,)|

BDBM159754

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)[C@H]1C[C@@](C)(CC#N)C1)c1ncnc2[nH]ccc12 |r,wU:12.13,wD:2.1,4.6,10.10,12.14,(-5.89,1.48,;-4.55,.71,;-3.22,1.48,;-2.82,2.97,;-1.33,2.57,;-1.73,1.09,;,3.34,;1.33,2.57,;.56,1.24,;2.1,3.91,;2.67,1.8,;3.07,.32,;4.55,.71,;5.89,1.48,;5.89,-.06,;5.89,-1.6,;5.89,-3.14,;4.15,2.2,;-4.55,-.83,;-5.89,-1.6,;-5.89,-3.14,;-4.55,-3.91,;-3.22,-3.14,;-1.76,-3.61,;-.85,-2.37,;-1.76,-1.12,;-3.22,-1.6,)|

BDBM159755

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)[C@H]1C[C@](C)(CC#N)C1)c1ncnc2[nH]ccc12 |r,wU:12.14,wD:2.1,4.6,10.10,12.13,(-5.49,3.28,;-4.4,2.19,;-2.91,2.59,;-2.14,3.92,;-.81,3.15,;-1.58,1.82,;.68,3.55,;1.77,2.46,;3.26,2.86,;1.37,.97,;2.86,1.37,;2.86,-.17,;4.4,-.17,;5.73,.6,;5.49,-1.26,;4.72,-2.59,;3.95,-3.92,;4.4,1.37,;-4.4,.65,;-5.73,-.12,;-5.73,-1.66,;-4.4,-2.43,;-3.06,-1.66,;-1.6,-2.14,;-.69,-.89,;-1.6,.36,;-3.06,-.12,)|

BDBM159756

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)c1cc(ccn1)C#N)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(-5.61,1.61,;-4.28,.84,;-2.94,1.61,;-2.55,3.09,;-1.06,2.69,;-1.46,1.21,;.28,3.47,;1.61,2.69,;.52,1.61,;2.7,3.78,;2.94,1.93,;2.94,.38,;4.28,-.38,;5.61,.38,;5.61,1.93,;4.28,2.69,;4.28,-1.92,;4.28,-3.46,;-4.28,-.7,;-5.61,-1.47,;-5.61,-3.01,;-4.28,-3.78,;-2.94,-3.01,;-1.48,-3.49,;-.57,-2.24,;-1.48,-1,;-2.94,-1.47,)|

BDBM159757

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)c1cccc(c1)C(C)(C)O)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(-6.71,-.25,;-5.38,-1.02,;-4.04,-.25,;-4.04,1.29,;-2.5,1.29,;-2.5,-.25,;-1.42,2.38,;.07,1.98,;1.41,1.21,;-.33,.49,;1.16,3.07,;.76,4.55,;1.85,5.64,;3.34,5.24,;3.74,3.76,;2.65,2.67,;5.22,3.36,;6.31,4.45,;6.71,2.96,;5.62,1.87,;-5.38,-2.56,;-6.71,-3.33,;-6.71,-4.87,;-5.38,-5.64,;-4.04,-4.87,;-2.58,-5.35,;-1.67,-4.1,;-2.58,-2.86,;-4.04,-3.33,)|

BDBM159758

CN([C@H]1C[C@@H](C1)NS(=O)(=O)CC1CC1)c1ncnc2[nH]ccc12 |r,wU:4.6,wD:2.1,(-5.71,1.77,;-4.38,1,;-3.05,1.77,;-1.56,1.37,;-1.16,2.85,;-2.65,3.25,;.17,3.62,;1.51,2.85,;.74,1.52,;2.6,1.77,;2.84,3.62,;4.17,2.85,;4.94,1.52,;5.71,2.85,;-4.38,-.54,;-5.71,-1.31,;-5.71,-2.85,;-4.38,-3.62,;-3.05,-2.85,;-1.58,-3.33,;-.68,-2.08,;-1.58,-.84,;-3.05,-1.31,)|

BDBM159759

CCCS(=O)(=O)N[C@H]1CC[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r|

BDBM159760

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)CC1CC(F)(F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(-5.73,.84,;-4.4,.07,;-3.06,.84,;-3.06,2.38,;-1.52,2.38,;-1.52,.84,;-.44,3.47,;1.05,3.07,;1.45,4.55,;.65,1.58,;2.54,2.67,;3.31,1.33,;2.91,-.15,;4.4,-.55,;5.73,-1.32,;3.63,-1.89,;4.8,.94,;-4.4,-1.47,;-5.73,-2.24,;-5.73,-3.78,;-4.4,-4.55,;-3.06,-3.78,;-1.6,-4.26,;-.69,-3.01,;-1.6,-1.77,;-3.06,-2.24,)|

BDBM159761

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)C1CC(F)(F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(-5.69,.29,;-4.36,-.48,;-3.03,.29,;-2.63,1.78,;-1.14,1.38,;-1.54,-.11,;.19,2.15,;1.53,1.38,;.44,.29,;2.61,.29,;2.61,2.47,;4.15,2.47,;4.15,4.01,;5.69,4.01,;5.24,5.1,;2.61,4.01,;-4.36,-2.02,;-5.69,-2.79,;-5.69,-4.33,;-4.36,-5.1,;-3.03,-4.33,;-1.56,-4.8,;-.66,-3.56,;-1.56,-2.31,;-3.03,-2.79,)|

BDBM159762

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)CC1CC1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(-5.71,1.77,;-4.38,1,;-3.05,1.77,;-2.65,3.25,;-1.16,2.85,;-1.56,1.37,;.17,3.62,;1.51,2.85,;.74,1.52,;2.6,1.77,;2.84,3.62,;4.17,2.85,;4.94,1.52,;5.71,2.85,;-4.38,-.54,;-5.71,-1.31,;-5.71,-2.85,;-4.38,-3.62,;-3.05,-2.85,;-1.58,-3.33,;-.68,-2.08,;-1.58,-.84,;-3.05,-1.31,)|

BDBM159763

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)C1CN(C1)C1CC1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(-6.66,1.77,;-5.32,1,;-3.99,1.77,;-3.59,3.25,;-2.1,2.85,;-2.5,1.37,;-.77,3.62,;.56,2.85,;.56,1.31,;1.9,3.62,;1.9,2.08,;2.3,.6,;3.78,1,;3.38,2.48,;5.12,.23,;5.89,-1.11,;6.66,.23,;-5.32,-.54,;-6.66,-1.31,;-6.66,-2.85,;-5.32,-3.62,;-3.99,-2.85,;-2.53,-3.33,;-1.62,-2.08,;-2.53,-.84,;-3.99,-1.31,)|

BDBM159764

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)NCC1CC1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(-6.38,1.1,;-5.05,.33,;-3.71,1.1,;-3.32,2.59,;-1.83,2.19,;-2.23,.7,;-.49,2.96,;.84,2.19,;.07,.85,;1.61,.85,;2.17,2.96,;3.51,2.19,;4.84,2.96,;6.38,2.96,;5.61,4.29,;-5.05,-1.21,;-6.38,-1.98,;-6.38,-3.52,;-5.05,-4.29,;-3.71,-3.52,;-2.25,-4,;-1.34,-2.75,;-2.25,-1.51,;-3.71,-1.98,)|

BDBM159765

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)N1CC[C@H](C1)C#N)c1ncnc2[nH]ccc12 |r,wU:13.16,wD:2.1,4.6,(-5.47,1.61,;-4.14,.84,;-2.8,1.61,;-2.4,3.09,;-.92,2.69,;-1.32,1.21,;.42,3.47,;1.75,2.69,;.66,1.61,;2.84,3.78,;3.08,1.93,;4.57,2.4,;5.47,1.15,;4.57,-.1,;3.1,.38,;4.96,-1.58,;5.36,-3.07,;-4.14,-.7,;-5.47,-1.47,;-5.47,-3.01,;-4.14,-3.78,;-2.8,-3.01,;-1.34,-3.49,;-.43,-2.24,;-1.34,-1,;-2.8,-1.47,)|

BDBM159766

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)N1CC[C@@H](C1)C#N)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,13.16,(-5.79,1.48,;-4.45,.71,;-3.12,1.48,;-2.72,2.97,;-1.23,2.57,;-1.63,1.09,;.1,3.34,;1.43,2.57,;.66,1.24,;2.2,3.91,;2.77,1.8,;4.25,2.27,;5.15,1.03,;4.25,-.22,;2.78,.26,;5.02,-1.55,;5.79,-2.89,;-4.45,-.83,;-5.79,-1.6,;-5.79,-3.14,;-4.45,-3.91,;-3.12,-3.14,;-1.66,-3.61,;-.75,-2.37,;-1.66,-1.12,;-3.12,-1.6,)|

BDBM159767

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)N1Cc2cn(C)nc2C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(-6.86,-.01,;-5.53,-.78,;-4.19,-.01,;-3.8,1.48,;-2.31,1.08,;-2.71,-.41,;-.97,1.85,;.36,1.08,;-.73,-.01,;1.13,-.26,;1.69,1.85,;3.16,1.37,;4.06,2.62,;5.53,3.09,;5.53,4.63,;6.86,5.4,;4.06,5.11,;3.16,3.86,;1.69,3.39,;-5.53,-2.32,;-6.86,-3.09,;-6.86,-4.63,;-5.53,-5.4,;-4.19,-4.63,;-2.86,-5.4,;-1.53,-4.63,;-1.53,-3.09,;-4.19,-3.09,)|

BDBM159768

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)N1C[C@@H]2C[C@H](C1)O2)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,12.18,14.17,(-5.92,1.22,;-4.58,.45,;-3.25,1.22,;-2.85,2.71,;-1.37,2.31,;-1.76,.82,;-.03,3.08,;1.46,2.68,;1.85,4.17,;.69,1.35,;2.94,2.28,;3.34,.8,;4.83,.4,;4.43,1.88,;5.52,2.97,;4.03,3.37,;5.92,1.49,;-4.58,-1.09,;-5.92,-1.86,;-5.92,-3.4,;-4.58,-4.17,;-3.25,-3.4,;-1.79,-3.87,;-.88,-2.63,;-1.79,-1.38,;-3.25,-1.86,)|

BDBM159769

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)N1CC(C1)C#N)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(-6.55,1.61,;-5.22,.84,;-3.89,1.61,;-3.49,3.09,;-2,2.69,;-2.4,1.21,;-.67,3.47,;.67,2.69,;-.42,1.61,;1.76,3.78,;2,1.93,;2.4,.44,;3.89,.84,;3.49,2.32,;5.22,.07,;6.55,-.7,;-5.22,-.7,;-6.55,-1.47,;-6.55,-3.01,;-5.22,-3.78,;-3.89,-3.01,;-2.42,-3.49,;-1.52,-2.24,;-2.42,-1,;-3.89,-1.47,)|

BDBM159770

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)N1CCC(CC1)c1cc[nH]n1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(-7.52,1.48,;-6.19,.71,;-4.86,1.48,;-4.46,2.97,;-2.97,2.57,;-3.37,1.09,;-1.64,3.34,;-.3,2.57,;-1.07,1.24,;.47,3.91,;1.03,1.8,;1.03,.26,;2.36,-.51,;3.7,.26,;3.7,1.8,;2.36,2.57,;5.03,-.51,;6.28,.4,;7.52,-.51,;7.05,-1.97,;5.51,-1.97,;-6.19,-.83,;-7.52,-1.6,;-7.52,-3.14,;-6.19,-3.91,;-4.86,-3.14,;-3.39,-3.61,;-2.49,-2.37,;-3.39,-1.12,;-4.86,-1.6,)|

BDBM159771

CN(CCC#N)S(=O)(=O)N[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:12.14,10.9,(1.61,4.39,;1.61,2.85,;2.94,2.08,;4.28,2.85,;5.61,2.08,;6.94,1.31,;.28,2.08,;-.49,.75,;1.05,.75,;-1.06,2.85,;-2.39,2.08,;-3.88,2.48,;-4.28,1,;-2.79,.6,;-5.61,.23,;-6.94,1,;-5.61,-1.31,;-6.94,-2.08,;-6.94,-3.62,;-5.61,-4.39,;-4.28,-3.62,;-2.81,-4.1,;-1.91,-2.85,;-2.81,-1.61,;-4.28,-2.08,)|

BDBM159772

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)N1C[C@H]2C[C@]2(C1)C#N)c1ncnc2[nH]ccc12 |r,wU:14.18,wD:2.1,4.6,12.13,(-6.58,1.61,;-5.25,.84,;-3.92,1.61,;-3.52,3.09,;-2.03,2.69,;-2.43,1.21,;-.7,3.47,;.64,2.69,;-.45,1.61,;1.72,3.78,;1.97,1.93,;2.13,.39,;3.64,.07,;5.18,.07,;4.41,1.41,;3.38,2.55,;5.5,2.5,;6.58,3.58,;-5.25,-.7,;-6.58,-1.47,;-6.58,-3.01,;-5.25,-3.78,;-3.92,-3.01,;-2.45,-3.49,;-1.55,-2.24,;-2.45,-1,;-3.92,-1.47,)|

BDBM159773

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)N1C[C@@H]2C[C@@]2(C1)C#N)c1ncnc2[nH]ccc12 |r,wU:12.13,wD:2.1,4.6,14.18,(-6.58,1.48,;-5.25,.71,;-3.92,1.48,;-3.52,2.97,;-2.03,2.57,;-2.43,1.09,;-.7,3.34,;.64,2.57,;-.13,1.24,;1.41,3.91,;1.97,1.8,;2.13,.27,;3.64,-.05,;5.18,-.05,;4.41,1.28,;3.38,2.43,;5.5,2.37,;6.58,3.46,;-5.25,-.83,;-6.58,-1.6,;-6.58,-3.14,;-5.25,-3.91,;-3.92,-3.14,;-2.45,-3.61,;-1.55,-2.37,;-2.45,-1.12,;-3.92,-1.6,)|

BDBM159774

CN([C@H]1C[C@@H](C1)NS(=O)(=O)N1CCC(C1)C#N)c1ncnc2[nH]ccc12 |r,w:13.16,wU:4.6,wD:2.1,(-5.78,-.58,;-4.45,-1.35,;-3.11,-.58,;-1.62,-.97,;-1.23,.51,;-2.71,.91,;.11,1.28,;1.44,.51,;.67,-.82,;2.21,-.82,;2.77,1.28,;4.24,.81,;5.14,2.05,;4.24,3.3,;2.77,2.82,;5.01,4.63,;5.78,5.97,;-4.45,-2.89,;-5.78,-3.66,;-5.78,-5.2,;-4.45,-5.97,;-3.11,-5.2,;-1.65,-5.67,;-.74,-4.43,;-1.65,-3.18,;-3.11,-3.66,)|

BDBM159775

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCC(F)(F)CC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.79,-.25,;-4.45,-1.02,;-3.12,-.25,;-2.72,1.23,;-1.23,.84,;.1,1.61,;1.43,.84,;.34,-.25,;2.52,-.25,;2.52,1.93,;4.01,1.53,;5.1,2.62,;4.7,4.1,;5.79,5.19,;4.7,5.64,;3.21,4.5,;2.12,3.41,;-1.63,-.65,;-4.45,-2.56,;-5.79,-3.33,;-5.79,-4.87,;-4.45,-5.64,;-3.12,-4.87,;-1.66,-5.35,;-.75,-4.1,;-1.66,-2.86,;-3.12,-3.33,)|

BDBM159776

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCC(O)(CC2)C(F)(F)F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.8,-.33,;-5.47,-1.1,;-4.14,-.33,;-4.14,1.21,;-2.6,1.21,;-1.51,2.3,;-.17,1.53,;-.94,.19,;.92,.44,;1.16,2.3,;2.49,1.53,;3.83,2.3,;3.83,3.84,;3.83,5.38,;2.49,4.61,;1.16,3.84,;5.32,4.23,;6.4,3.15,;5.71,5.72,;6.8,4.63,;-2.6,-.33,;-5.47,-2.64,;-6.8,-3.41,;-6.8,-4.95,;-5.47,-5.72,;-4.14,-4.95,;-2.67,-5.43,;-1.77,-4.18,;-2.67,-2.94,;-4.14,-3.41,)|

BDBM159777

CN([C@@H]1C[C@H](CS(=O)(=O)N2CC[C@H](C2)C#N)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,12.14,(-7.01,1.61,;-5.68,.84,;-4.34,1.61,;-3.94,3.09,;-2.46,2.69,;-1.12,3.47,;.21,2.69,;-.88,1.61,;1.3,3.78,;1.54,1.93,;1.56,.38,;3.03,-.1,;3.93,1.15,;3.03,2.4,;5.47,1.15,;7.01,1.15,;-2.86,1.21,;-5.68,-.7,;-7.01,-1.47,;-7.01,-3.01,;-5.68,-3.78,;-4.34,-3.01,;-2.88,-3.49,;-1.97,-2.24,;-2.88,-1,;-4.34,-1.47,)|

BDBM159778

CN([C@@H]1C[C@H](CS(=O)(=O)N2CC[C@@H](C2)C#N)C1)c1ncnc2[nH]ccc12 |r,wU:12.14,wD:2.1,4.4,(-7.01,1.61,;-5.68,.84,;-4.34,1.61,;-3.94,3.09,;-2.46,2.69,;-1.12,3.47,;.21,2.69,;-.88,1.61,;1.3,3.78,;1.54,1.93,;1.56,.38,;3.03,-.1,;3.93,1.15,;3.03,2.4,;5.47,1.15,;7.01,1.15,;-2.86,1.21,;-5.68,-.7,;-7.01,-1.47,;-7.01,-3.01,;-5.68,-3.78,;-4.34,-3.01,;-2.88,-3.49,;-1.97,-2.24,;-2.88,-1,;-4.34,-1.47,)|

BDBM159779

CCCCS(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:10.12,8.7,(5.98,3.24,;4.65,4.01,;3.32,3.24,;1.98,4.01,;.65,3.24,;-.12,1.91,;1.74,2.15,;-.69,4.01,;-1.78,2.92,;-3.32,2.92,;-3.32,1.38,;-1.78,1.38,;-4.65,.61,;-5.98,1.38,;-4.65,-.93,;-5.98,-1.7,;-5.98,-3.24,;-4.65,-4.01,;-3.32,-3.24,;-1.85,-3.72,;-.95,-2.47,;-1.85,-1.22,;-3.32,-1.7,)|

BDBM159780

CCCS(=O)(=O)C[C@H]1C[C@@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:7.6,wD:9.11,(5.44,2.67,;3.95,2.27,;2.86,3.36,;1.37,2.96,;-.11,3.36,;1.37,4.5,;.97,1.48,;-.51,1.08,;-1.28,-.26,;-2.62,.51,;-1.85,1.85,;-4.1,.12,;-5.19,1.2,;-4.1,-1.42,;-5.44,-2.19,;-5.44,-3.73,;-4.1,-4.5,;-2.77,-3.73,;-1.31,-4.21,;-.4,-2.96,;-1.31,-1.72,;-2.77,-2.19,)|

BDBM159781

CN([C@@H]1C[C@H](CS(=O)(=O)CCC2CC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.82,.84,;-4.49,.07,;-3.16,.84,;-3.16,2.38,;-1.62,2.38,;-.53,3.47,;.96,3.07,;1.36,4.55,;.56,1.58,;2.45,2.67,;2.85,1.18,;4.33,.78,;5.42,-.31,;5.82,1.18,;-1.62,.84,;-4.49,-1.47,;-5.82,-2.24,;-5.82,-3.78,;-4.49,-4.55,;-3.16,-3.78,;-1.69,-4.26,;-.79,-3.01,;-1.69,-1.77,;-3.16,-2.24,)|

BDBM159782

CN([C@@H]1C[C@H](CS(=O)(=O)CC2CC(F)(F)C2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.34,1.38,;-5,.61,;-3.67,1.38,;-3.67,2.92,;-2.13,2.92,;-1.04,4.01,;.29,3.24,;-.48,1.91,;1.38,2.15,;1.63,4.01,;2.96,3.24,;3.36,1.75,;4.85,2.15,;6.34,2.55,;5.62,.82,;4.45,3.64,;-2.13,1.38,;-5,-.93,;-6.34,-1.7,;-6.34,-3.24,;-5,-4.01,;-3.67,-3.24,;-2.2,-3.72,;-1.3,-2.47,;-2.2,-1.22,;-3.67,-1.7,)|

BDBM159783

CN([C@@H]1C[C@H](CS(=O)(=O)[C@H]2CC[C@@H](C2)C#N)C1)c1ncnc2[nH]ccc12 |r,wU:12.14,wD:2.1,4.4,9.8,(-7.01,1.61,;-5.68,.84,;-4.34,1.61,;-3.94,3.09,;-2.46,2.69,;-1.12,3.47,;.21,2.69,;-.88,1.61,;1.3,3.78,;1.54,1.93,;1.56,.38,;3.03,-.1,;3.93,1.15,;3.03,2.4,;5.47,1.15,;7.01,1.15,;-2.86,1.21,;-5.68,-.7,;-7.01,-1.47,;-7.01,-3.01,;-5.68,-3.78,;-4.34,-3.01,;-2.88,-3.49,;-1.97,-2.24,;-2.88,-1,;-4.34,-1.47,)|

BDBM159784

CN([C@@H]1C[C@H](CS(=O)(=O)[C@@H]2CC[C@H](C2)C#N)C1)c1ncnc2[nH]ccc12 |r,wU:9.8,wD:2.1,4.4,12.14,(-7.01,1.61,;-5.68,.84,;-4.34,1.61,;-3.94,3.09,;-2.46,2.69,;-1.12,3.47,;.21,2.69,;-.88,1.61,;1.3,3.78,;1.54,1.93,;1.56,.38,;3.03,-.1,;3.93,1.15,;3.03,2.4,;5.47,1.15,;7.01,1.15,;-2.86,1.21,;-5.68,-.7,;-7.01,-1.47,;-7.01,-3.01,;-5.68,-3.78,;-4.34,-3.01,;-2.88,-3.49,;-1.97,-2.24,;-2.88,-1,;-4.34,-1.47,)|

BDBM159785

CC(C)N1CCC(C1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,w:8.8,wD:14.17,12.12,(6.62,4.68,;5.85,3.34,;6.62,2.01,;4.31,3.34,;3.4,4.59,;1.94,4.11,;1.94,2.57,;3.4,2.1,;.6,1.8,;-.49,.71,;1.94,1.03,;-.73,2.57,;-2.06,1.8,;-3.55,2.2,;-3.95,.71,;-2.46,.32,;-5.28,-.06,;-6.62,.71,;-5.28,-1.6,;-6.62,-2.37,;-6.62,-3.91,;-5.28,-4.68,;-3.95,-3.91,;-2.49,-4.38,;-1.58,-3.14,;-2.49,-1.89,;-3.95,-2.37,)|

BDBM159786

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccc(F)c(Cl)c2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.98,.23,;-4.65,-.54,;-3.32,.23,;-3.32,1.77,;-1.78,1.77,;-.69,2.85,;.65,2.08,;-.12,.75,;1.74,1,;1.98,2.85,;1.98,4.39,;3.32,5.16,;4.65,4.39,;5.98,5.16,;4.65,2.85,;5.98,2.08,;3.32,2.08,;-1.78,.23,;-4.65,-2.08,;-5.98,-2.85,;-5.98,-4.39,;-4.65,-5.16,;-3.32,-4.39,;-1.85,-4.87,;-.95,-3.62,;-1.85,-2.38,;-3.32,-2.85,)|

BDBM159787

CN([C@@H]1C[C@H](CS(=O)(=O)c2cc(ccn2)C#N)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.94,.61,;-5.61,-.16,;-4.28,.61,;-3.88,2.1,;-2.39,1.7,;-1.06,2.47,;.28,1.7,;-.49,.37,;1.05,.37,;1.61,2.47,;2.94,1.7,;4.28,2.47,;4.28,4.01,;2.94,4.78,;1.61,4.01,;5.61,1.7,;6.94,.93,;-2.79,.21,;-5.61,-1.7,;-6.94,-2.47,;-6.94,-4.01,;-5.61,-4.78,;-4.28,-4.01,;-2.81,-4.49,;-1.91,-3.24,;-2.81,-1.99,;-4.28,-2.47,)|

BDBM159788

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)c1cnc(C)s1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(-5.46,.09,;-4.13,-.68,;-2.79,.09,;-2.4,1.58,;-.91,1.18,;-1.31,-.31,;.43,1.95,;1.76,1.18,;.99,-.15,;2.53,-.15,;3.09,1.95,;4.56,1.47,;5.46,2.72,;4.56,3.97,;5.33,5.3,;3.09,3.49,;-4.13,-2.22,;-5.46,-2.99,;-5.46,-4.53,;-4.13,-5.3,;-2.79,-4.53,;-1.33,-5.01,;-.43,-3.76,;-1.33,-2.51,;-2.79,-2.99,)|

BDBM214688

Cc1cc(Nc2nc(nc3ccccc23)C(O)c2ccc(F)cc2)n[nH]1

BDBM214689

Cc1cc(Nc2nc(nc3ccccc23)[C@@H](O)c2ccc(F)cc2)n[nH]1

BDBM214690

Cc1cc(Nc2nc(nc3ccccc23)[C@H](O)c2ccc(F)cc2)n[nH]1

BDBM185700

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)c1ncnc2[nH]ccc12 |r,wU:9.12,wD:6.5,(5.44,3.81,;3.9,3.81,;2.56,3.04,;1.79,1.7,;3.33,1.7,;1.23,3.81,;-.1,3.04,;-1.44,3.81,;-2.77,3.04,;-2.77,1.5,;-1.44,.73,;-.1,1.5,;-4.1,.73,;-5.44,1.5,;-4.1,-.81,;-5.44,-1.58,;-5.44,-3.12,;-4.1,-3.89,;-2.77,-3.12,;-1.31,-3.6,;-.4,-2.35,;-1.31,-1.11,;-2.77,-1.58,)|

BDBM198193

Cc1nc(C2CCCCC2)c2c3cc[nH]c3ncn12

BDBM198194

C1CCC(CC1)c1ncn2cnc3[nH]ccc3c12

BDBM198195

O=C(OCc1ccccc1)N1CCCC(C1)c1ncn2cnc3[nH]ccc3c12

BDBM198196

O=C(CC#N)N1CCCC(C1)c1ncn2cnc3[nH]ccc3c12

BDBM198197

Cc1ccccc1-c1nnn2cnc3[nH]ccc3c12

BDBM198198

C1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198199

CC1CCCCC1c1nnn2cnc3[nH]ccc3c12

BDBM198200

S=c1[nH]c(C2CCCCC2)c2c3cc[nH]c3ncn12

BDBM198201

O=c1[nH]c(C2CCCCC2)c2c3cc[nH]c3ncn12

BDBM198202

OC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:5.8,wD:2.1,(4,4.07,;2.51,4.47,;1.42,3.38,;-.06,3.78,;-1.15,2.69,;-.75,1.2,;.73,.81,;1.82,1.89,;-1.84,.12,;-3.37,.28,;-4,-1.13,;-2.86,-2.16,;-2.86,-3.7,;-1.52,-4.47,;-.19,-3.7,;1.28,-4.18,;2.18,-2.93,;1.28,-1.69,;-.19,-2.16,;-1.52,-1.39,)|

BDBM198203

CC1CCN(CC1c1nnn2cnc3[nH]ccc3c12)C(=O)OC(C)(C)C

BDBM198204

CC1CCN(CC1c1nnn2cnc3[nH]ccc3c12)C(=O)CC#N

BDBM198205

CC(C)(C)OC(=O)N1CCCC(C1)c1nnn2cnc3[nH]ccc3c12

BDBM198206

O=C(OCc1ccccc1)N1CCCC(C1)c1nnn2cnc3[nH]ccc3c12

BDBM198207

C1CNCC(C1)c1nnn2cnc3[nH]ccc3c12

BDBM198208

C(N1CCCC(C1)c1nnn2cnc3[nH]ccc3c12)c1ccccc1

BDBM198209

FC(F)(F)CC(=O)N1CCCC(C1)c1nnn2cnc3[nH]ccc3c12

BDBM198210

C(N1CCCC(C1)c1nnn2cnc3[nH]ccc3c12)c1cccnc1

BDBM198211

C(N1CCCC(C1)c1nnn2cnc3[nH]ccc3c12)c1cncs1

BDBM198212

O=C(Nc1nncs1)N1CCCC(C1)c1nnn2cnc3[nH]ccc3c12

BDBM198213

Cc1cc(NC(=O)N2CCCC(C2)c2nnn3cnc4[nH]ccc4c23)sn1

BDBM198214

N#Cc1ccc(CN2CCCC(C2)c2nnn3cnc4[nH]ccc4c23)cc1

BDBM198215

FC(F)(F)c1ccc(CN2CCCC(C2)c2nnn3cnc4[nH]ccc4c23)cc1

BDBM198216

CC(C)(C)OC(=O)N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198217

FC(F)(F)CN1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198218

O=C(OCc1ccccc1)N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198219

C1CC(CCN1)c1nnn2cnc3[nH]ccc3c12

BDBM198220

C(N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)c1cccnc1

BDBM198221

FC(F)(F)CC(=O)N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198222

O=C(Nc1nncs1)N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198223

Cc1cc(NC(=O)N2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)sn1

BDBM198224

C(N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)c1ccccc1

BDBM198225

FC(F)(F)c1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1

BDBM198226

N#Cc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1

BDBM198227

N#Cc1cccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)c1

BDBM198228

Cc1noc(C)c1CN1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198229

FC(F)(F)Oc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1

BDBM198230

FC(F)(F)Sc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1

BDBM198231

FC(F)(F)c1cccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)c1

BDBM198232

Fc1cc(ccc1CN1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)C#N

BDBM198233

Brc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1

BDBM198234

FC(F)(F)c1ccc(CCN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1

BDBM198235

Fc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1

BDBM198236

C(N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)c1cncs1

BDBM198237

C(CN1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)Cc1ccccc1

BDBM198238

COc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1F

BDBM198239

FC(F)(F)c1cc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc(c1)C(F)(F)F

BDBM198240

C(N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)c1nccs1

BDBM198241

Clc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)s1

BDBM198242

C(C1CCCCC1)N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198243

C1CCC(C1)N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198244

FC(F)(F)c1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cn1

BDBM198245

Fc1cc(cc(F)c1CN1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)C#N

BDBM198246

Clc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1

BDBM198247

Fc1cccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)c1

BDBM198248

FC(F)(F)C1CCC(CC1)N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12 |(3.75,6.85,;4.15,5.36,;5.24,6.45,;5.63,4.96,;3.06,4.27,;3.46,2.78,;2.37,1.7,;.88,2.09,;.48,3.58,;1.57,4.67,;-.21,1.01,;.19,-.48,;-.9,-1.57,;-2.39,-1.17,;-2.79,.31,;-1.7,1.4,;-3.48,-2.26,;-5.01,-2.1,;-5.63,-3.51,;-4.49,-4.54,;-4.49,-6.08,;-3.16,-6.85,;-1.82,-6.08,;-.36,-6.55,;.55,-5.31,;-.36,-4.06,;-1.82,-4.54,;-3.16,-3.77,)|

BDBM198249

FC(F)(F)C1CCC(CC1)N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12 |(5.63,4.96,;4.15,5.36,;5.24,6.45,;3.75,6.85,;3.06,4.27,;3.46,2.78,;2.37,1.7,;.88,2.09,;.48,3.58,;1.57,4.67,;-.21,1.01,;.19,-.48,;-.9,-1.57,;-2.39,-1.17,;-2.79,.31,;-1.7,1.4,;-3.48,-2.26,;-5.01,-2.1,;-5.63,-3.51,;-4.49,-4.54,;-4.49,-6.08,;-3.16,-6.85,;-1.82,-6.08,;-.36,-6.55,;.55,-5.31,;-.36,-4.06,;-1.82,-4.54,;-3.16,-3.77,)|

BDBM198250

FC(F)(F)c1cccc(NC(=O)N2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)c1

BDBM198251

FC(F)(F)c1ccc(cc1)C(=O)N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198252

CC(C)(C)OC(=O)N[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:11.14,wD:8.7,(5.63,5.16,;4.55,4.07,;4.94,2.58,;6.03,3.67,;3.06,4.47,;1.97,3.38,;2.37,1.89,;.48,3.78,;-.61,2.69,;-2.1,3.09,;-3.18,2,;-2.79,.51,;-1.3,.12,;-.21,1.2,;-3.87,-.58,;-5.41,-.41,;-6.03,-1.82,;-4.89,-2.85,;-4.89,-4.39,;-3.55,-5.16,;-2.22,-4.39,;-.76,-4.87,;.15,-3.62,;-.76,-2.38,;-2.22,-2.85,;-3.55,-2.08,)|

BDBM198253

O=C(N[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)OCc1ccccc1 |r,wU:6.9,wD:3.2,(1.97,2.24,;1.57,3.73,;.08,4.13,;-1.01,3.04,;-2.49,3.44,;-3.58,2.35,;-3.18,.86,;-1.7,.46,;-.61,1.55,;-4.27,-.23,;-5.8,-.07,;-6.43,-1.48,;-5.29,-2.51,;-5.29,-4.05,;-3.95,-4.82,;-2.62,-4.05,;-1.15,-4.52,;-.25,-3.28,;-1.15,-2.03,;-2.62,-2.51,;-3.95,-1.74,;2.66,4.82,;4.15,4.42,;4.55,2.93,;3.46,1.84,;3.85,.35,;5.34,-.04,;6.43,1.04,;6.03,2.53,)|

BDBM198254

N[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:4.7,wD:1.0,(3.26,4.47,;2.17,3.38,;.68,3.78,;-.41,2.69,;-.01,1.2,;1.48,.81,;2.57,1.89,;-1.1,.12,;-2.63,.28,;-3.26,-1.13,;-2.11,-2.16,;-2.11,-3.7,;-.78,-4.47,;.55,-3.7,;2.02,-4.18,;2.92,-2.93,;2.02,-1.69,;.55,-2.16,;-.78,-1.39,)|

BDBM198255

COC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:6.9,wD:3.2,(4.55,4.82,;3.46,3.73,;1.97,4.13,;.88,3.04,;-.61,3.44,;-1.7,2.35,;-1.3,.86,;.19,.46,;1.28,1.55,;-2.39,-.23,;-3.92,-.07,;-4.55,-1.48,;-3.4,-2.51,;-3.4,-4.05,;-2.07,-4.82,;-.73,-4.05,;.73,-4.52,;1.64,-3.28,;.73,-2.03,;-.73,-2.51,;-2.07,-1.74,)|

BDBM198256

CO[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:5.8,wD:2.1,(4,4.07,;2.51,4.47,;1.42,3.38,;-.06,3.78,;-1.15,2.69,;-.75,1.2,;.73,.81,;1.82,1.89,;-1.84,.12,;-3.37,.28,;-4,-1.13,;-2.86,-2.16,;-2.86,-3.7,;-1.52,-4.47,;-.19,-3.7,;1.28,-4.18,;2.18,-2.93,;1.28,-1.69,;-.19,-2.16,;-1.52,-1.39,)|

BDBM198257

FC1(F)CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198258

C1CC2CC1CC2c1nnn2cnc3[nH]ccc3c12

BDBM198259

C1CCCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198260

C1CC(C1)c1nnn2cnc3[nH]ccc3c12

BDBM198262

FC(F)(F)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:7.10,wD:4.3,(4,3.33,;2.51,3.73,;2.11,5.21,;3.6,4.82,;1.42,2.64,;-.06,3.04,;-1.15,1.95,;-.75,.46,;.73,.06,;1.82,1.15,;-1.84,-.63,;-3.37,-.47,;-4,-1.87,;-2.86,-2.9,;-2.86,-4.44,;-1.52,-5.21,;-.19,-4.44,;1.28,-4.92,;2.18,-3.67,;1.28,-2.43,;-.19,-2.9,;-1.52,-2.13,)|

BDBM198264

CC(=O)SC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:8.11,wD:5.4,(5.29,3.67,;3.8,4.07,;3.4,5.56,;2.71,2.98,;1.22,3.38,;.14,2.29,;-1.35,2.69,;-2.44,1.6,;-2.04,.12,;-.55,-.28,;.53,.81,;-3.13,-.97,;-4.66,-.81,;-5.29,-2.22,;-4.14,-3.25,;-4.14,-4.79,;-2.81,-5.56,;-1.48,-4.79,;-.01,-5.27,;.89,-4.02,;-.01,-2.77,;-1.48,-3.25,;-2.81,-2.48,)|

BDBM198265

CC(=O)OC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:8.11,wD:5.4,(5.29,3.67,;3.8,4.07,;3.4,5.56,;2.71,2.98,;1.22,3.38,;.14,2.29,;-1.35,2.69,;-2.44,1.6,;-2.04,.12,;-.55,-.28,;.53,.81,;-3.13,-.97,;-4.66,-.81,;-5.29,-2.22,;-4.14,-3.25,;-4.14,-4.79,;-2.81,-5.56,;-1.48,-4.79,;-.01,-5.27,;.89,-4.02,;-.01,-2.77,;-1.48,-3.25,;-2.81,-2.48,)|

BDBM198266

FC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:5.8,wD:2.1,(4,4.07,;2.51,4.47,;1.42,3.38,;-.06,3.78,;-1.15,2.69,;-.75,1.2,;.73,.81,;1.82,1.89,;-1.84,.12,;-3.37,.28,;-4,-1.13,;-2.86,-2.16,;-2.86,-3.7,;-1.52,-4.47,;-.19,-3.7,;1.28,-4.18,;2.18,-2.93,;1.28,-1.69,;-.19,-2.16,;-1.52,-1.39,)|

BDBM198267

BrC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:5.8,wD:2.1,(4,4.07,;2.51,4.47,;1.42,3.38,;-.06,3.78,;-1.15,2.69,;-.75,1.2,;.73,.81,;1.82,1.89,;-1.84,.12,;-3.37,.28,;-4,-1.13,;-2.86,-2.16,;-2.86,-3.7,;-1.52,-4.47,;-.19,-3.7,;1.28,-4.18,;2.18,-2.93,;1.28,-1.69,;-.19,-2.16,;-1.52,-1.39,)|

BDBM198268

ClC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:5.8,wD:2.1,(4,4.07,;2.51,4.47,;1.42,3.38,;-.06,3.78,;-1.15,2.69,;-.75,1.2,;.73,.81,;1.82,1.89,;-1.84,.12,;-3.37,.28,;-4,-1.13,;-2.86,-2.16,;-2.86,-3.7,;-1.52,-4.47,;-.19,-3.7,;1.28,-4.18,;2.18,-2.93,;1.28,-1.69,;-.19,-2.16,;-1.52,-1.39,)|

BDBM198269

SC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:5.8,wD:2.1,(4,4.07,;2.51,4.47,;1.42,3.38,;-.06,3.78,;-1.15,2.69,;-.75,1.2,;.73,.81,;1.82,1.89,;-1.84,.12,;-3.37,.28,;-4,-1.13,;-2.86,-2.16,;-2.86,-3.7,;-1.52,-4.47,;-.19,-3.7,;1.28,-4.18,;2.18,-2.93,;1.28,-1.69,;-.19,-2.16,;-1.52,-1.39,)|

BDBM198270

CS(=O)(=O)C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:8.11,wD:5.4,(4.42,4.82,;3.33,3.73,;3.33,2.19,;4.67,2.96,;1.85,4.13,;.76,3.04,;-.73,3.44,;-1.82,2.35,;-1.42,.86,;.07,.46,;1.16,1.55,;-2.51,-.23,;-4.04,-.07,;-4.67,-1.48,;-3.52,-2.51,;-3.52,-4.05,;-2.19,-4.82,;-.86,-4.05,;.61,-4.52,;1.51,-3.28,;.61,-2.03,;-.86,-2.51,;-2.19,-1.74,)|

BDBM198271

O=C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:5.8,wD:2.1,(4,4.07,;2.51,4.47,;1.42,3.38,;-.06,3.78,;-1.15,2.69,;-.75,1.2,;.73,.81,;1.82,1.89,;-1.84,.12,;-3.37,.28,;-4,-1.13,;-2.86,-2.16,;-2.86,-3.7,;-1.52,-4.47,;-.19,-3.7,;1.28,-4.18,;2.18,-2.93,;1.28,-1.69,;-.19,-2.16,;-1.52,-1.39,)|

BDBM198272

FC(F)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:6.9,wD:3.2,(4,3.33,;2.51,3.73,;2.11,5.21,;1.42,2.64,;-.06,3.04,;-1.15,1.95,;-.75,.46,;.73,.06,;1.82,1.15,;-1.84,-.63,;-3.37,-.47,;-4,-1.87,;-2.86,-2.9,;-2.86,-4.44,;-1.52,-5.21,;-.19,-4.44,;1.28,-4.92,;2.18,-3.67,;1.28,-2.43,;-.19,-2.9,;-1.52,-2.13,)|

BDBM198274

O[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:4.7,wD:1.0,(3.26,4.47,;2.17,3.38,;.68,3.78,;-.41,2.69,;-.01,1.2,;1.48,.81,;2.57,1.89,;-1.1,.12,;-2.63,.28,;-3.26,-1.13,;-2.11,-2.16,;-2.11,-3.7,;-.78,-4.47,;.55,-3.7,;2.02,-4.18,;2.92,-2.93,;2.02,-1.69,;.55,-2.16,;-.78,-1.39,)|

BDBM198275

O=C1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198276

O[C@H]1CC[C@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:4.7,1.0,(3.26,4.47,;2.17,3.38,;2.57,1.89,;1.48,.81,;-.01,1.2,;-.41,2.69,;.68,3.78,;-1.1,.12,;-2.63,.28,;-3.26,-1.13,;-2.11,-2.16,;-2.11,-3.7,;-.78,-4.47,;.55,-3.7,;2.02,-4.18,;2.92,-2.93,;2.02,-1.69,;.55,-2.16,;-.78,-1.39,)|

BDBM198277

O=C(OCc1ccccc1)N1CCC(CC1)c1ncn2cnc3[nH]ccc3c12

BDBM198278

O=C(OCc1ccccc1)N1CCC(CC1)c1[nH]c(=S)n2cnc3[nH]ccc3c12

BDBM198279

FC(F)(F)c1ccc(CN2CCC(CC2)c2[nH]c(=S)n3cnc4[nH]ccc4c23)cc1

BDBM198281

O=S1(=O)CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)CC1 |r,wU:10.13,wD:7.6,(6.23,3.33,;4.74,2.93,;5.83,1.84,;3.66,1.84,;2.17,2.24,;1.77,3.73,;.28,4.13,;-.81,3.04,;-2.29,3.44,;-3.38,2.35,;-2.98,.86,;-1.5,.46,;-.41,1.55,;-4.07,-.23,;-5.61,-.07,;-6.23,-1.48,;-5.09,-2.51,;-5.09,-4.05,;-3.75,-4.82,;-2.42,-4.05,;-.96,-4.52,;-.05,-3.28,;-.96,-2.03,;-2.42,-2.51,;-3.75,-1.74,;2.86,4.82,;4.35,4.42,)|

BDBM198282

N#CC1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)CC1 |r,wU:10.13,wD:7.6,(6.98,2.13,;5.49,2.53,;4,2.93,;2.91,1.84,;1.42,2.24,;1.03,3.73,;-.46,4.13,;-1.55,3.04,;-3.04,3.44,;-4.13,2.35,;-3.73,.86,;-2.24,.46,;-1.15,1.55,;-4.82,-.23,;-6.35,-.07,;-6.98,-1.48,;-5.83,-2.51,;-5.83,-4.05,;-4.5,-4.82,;-3.16,-4.05,;-1.7,-4.52,;-.79,-3.28,;-1.7,-2.03,;-3.16,-2.51,;-4.5,-1.74,;2.11,4.82,;3.6,4.42,)|

BDBM198283

N#CCCNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:9.12,wD:6.5,(6.38,5.71,;5.29,4.62,;4.2,3.53,;2.71,3.93,;1.62,2.84,;.14,3.24,;-.95,2.15,;-2.44,2.55,;-3.53,1.46,;-3.13,-.03,;-1.64,-.43,;-.55,.66,;-4.22,-1.12,;-5.75,-.96,;-6.38,-2.37,;-5.23,-3.4,;-5.23,-4.94,;-3.9,-5.71,;-2.57,-4.94,;-1.1,-5.41,;-.2,-4.17,;-1.1,-2.92,;-2.57,-3.4,;-3.9,-2.63,)|

BDBM198284

C([C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)N1CCOCC1 |r,wU:4.7,wD:1.0,(1.03,4.13,;-.06,3.04,;-1.55,3.44,;-2.64,2.35,;-2.24,.86,;-.75,.46,;.34,1.55,;-3.33,-.23,;-4.86,-.07,;-5.49,-1.48,;-4.34,-2.51,;-4.34,-4.05,;-3.01,-4.82,;-1.68,-4.05,;-.21,-4.52,;.69,-3.28,;-.21,-2.03,;-1.68,-2.51,;-3.01,-1.74,;2.51,3.73,;2.91,2.24,;4.4,1.84,;5.49,2.93,;5.09,4.42,;3.6,4.82,)|

BDBM198285

N#Cc1ccc(NC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:11.14,wD:8.7,(6.72,6.99,;5.63,5.91,;4.55,4.82,;4.94,3.33,;3.85,2.24,;2.37,2.64,;1.28,1.55,;-.21,1.95,;-1.3,.86,;-2.79,1.26,;-3.87,.17,;-3.48,-1.32,;-1.99,-1.72,;-.9,-.63,;-4.57,-2.41,;-6.1,-2.25,;-6.72,-3.65,;-5.58,-4.68,;-5.58,-6.22,;-4.24,-6.99,;-2.91,-6.22,;-1.45,-6.7,;-.54,-5.45,;-1.45,-4.21,;-2.91,-4.68,;-4.24,-3.91,;1.97,4.13,;3.06,5.21,)|

BDBM198286

N#Cc1ccc(CNC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:12.15,wD:9.8,(8.26,2.48,;6.78,2.88,;5.29,3.28,;4.89,4.76,;3.4,5.16,;2.31,4.07,;.83,4.47,;-.26,3.38,;-1.75,3.78,;-2.84,2.69,;-4.33,3.09,;-5.42,2,;-5.02,.51,;-3.53,.12,;-2.44,1.2,;-6.11,-.58,;-7.64,-.41,;-8.26,-1.82,;-7.12,-2.85,;-7.12,-4.39,;-5.79,-5.16,;-4.45,-4.39,;-2.99,-4.87,;-2.08,-3.62,;-2.99,-2.38,;-4.45,-2.85,;-5.79,-2.08,;2.71,2.58,;4.2,2.19,)|

BDBM198287

F[C@H]1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:9.12,1.0,wD:6.5,(5.91,4.59,;4.58,3.82,;4.1,2.35,;2.56,2.35,;2.09,3.82,;.6,4.22,;-.49,3.13,;-1.98,3.53,;-3.07,2.44,;-2.67,.95,;-1.18,.55,;-.09,1.64,;-3.76,-.14,;-5.29,.02,;-5.91,-1.38,;-4.77,-2.41,;-4.77,-3.95,;-3.44,-4.72,;-2.1,-3.95,;-.64,-4.43,;.27,-3.18,;-.64,-1.94,;-2.1,-2.41,;-3.44,-1.64,;3.33,4.72,)|

BDBM198288

F[C@@H]1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:9.12,wD:6.5,1.0,(5.91,4.59,;4.58,3.82,;4.1,2.35,;2.56,2.35,;2.09,3.82,;.6,4.22,;-.49,3.13,;-1.98,3.53,;-3.07,2.44,;-2.67,.95,;-1.18,.55,;-.09,1.64,;-3.76,-.14,;-5.29,.02,;-5.91,-1.38,;-4.77,-2.41,;-4.77,-3.95,;-3.44,-4.72,;-2.1,-3.95,;-.64,-4.43,;.27,-3.18,;-.64,-1.94,;-2.1,-2.41,;-3.44,-1.64,;3.33,4.72,)|

BDBM198289

CC1(C)CN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:9.12,wD:6.5,(5.8,3.72,;4.31,3.32,;5.4,2.23,;2.98,2.55,;2.21,3.89,;.72,4.29,;-.37,3.2,;-1.86,3.6,;-2.95,2.51,;-2.55,1.02,;-1.06,.62,;.03,1.71,;-3.64,-.07,;-5.17,.09,;-5.8,-1.32,;-4.65,-2.35,;-4.65,-3.89,;-3.32,-4.66,;-1.98,-3.89,;-.52,-4.36,;.39,-3.12,;-.52,-1.87,;-1.98,-2.35,;-3.32,-1.58,;3.54,4.66,)|

BDBM198290

FC1(F)CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)CC1 |r,wU:10.13,wD:7.6,(6.23,3.33,;4.74,2.93,;5.83,1.84,;3.66,1.84,;2.17,2.24,;1.77,3.73,;.28,4.13,;-.81,3.04,;-2.29,3.44,;-3.38,2.35,;-2.98,.86,;-1.5,.46,;-.41,1.55,;-4.07,-.23,;-5.61,-.07,;-6.23,-1.48,;-5.09,-2.51,;-5.09,-4.05,;-3.75,-4.82,;-2.42,-4.05,;-.96,-4.52,;-.05,-3.28,;-.96,-2.03,;-2.42,-2.51,;-3.75,-1.74,;2.86,4.82,;4.35,4.42,)|

BDBM198291

FC(F)(F)c1ccc(CNC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:14.17,wD:11.10,(8.26,2.48,;6.78,2.88,;7.17,1.39,;7.87,3.97,;5.29,3.28,;4.89,4.76,;3.4,5.16,;2.31,4.07,;.83,4.47,;-.26,3.38,;-1.75,3.78,;-2.84,2.69,;-4.33,3.09,;-5.42,2,;-5.02,.51,;-3.53,.12,;-2.44,1.2,;-6.11,-.58,;-7.64,-.41,;-8.26,-1.82,;-7.12,-2.85,;-7.12,-4.39,;-5.79,-5.16,;-4.45,-4.39,;-2.99,-4.87,;-2.08,-3.62,;-2.99,-2.38,;-4.45,-2.85,;-5.79,-2.08,;2.71,2.58,;4.2,2.19,)|

BDBM198292

FC(F)(F)c1ccc(NC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:13.16,wD:10.9,(6.92,5.31,;5.43,5.71,;5.04,7.19,;6.52,6.79,;4.35,4.62,;2.86,5.02,;1.77,3.93,;2.17,2.44,;1.08,1.35,;-.41,1.75,;-1.5,.66,;-2.98,1.06,;-4.07,-.03,;-3.68,-1.52,;-2.19,-1.92,;-1.1,-.83,;-4.76,-2.61,;-6.3,-2.45,;-6.92,-3.85,;-5.78,-4.88,;-5.78,-6.42,;-4.44,-7.19,;-3.11,-6.42,;-1.65,-6.9,;-.74,-5.65,;-1.65,-4.41,;-3.11,-4.88,;-4.44,-4.11,;3.66,2.04,;4.74,3.13,)|

BDBM198293

Fc1ccc(NC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:10.13,wD:7.6,(6.18,6.45,;5.09,5.36,;3.6,5.76,;2.51,4.67,;2.91,3.18,;1.82,2.09,;.34,2.49,;-.75,1.4,;-2.24,1.8,;-3.33,.71,;-2.93,-.77,;-1.44,-1.17,;-.36,-.08,;-4.02,-1.86,;-5.55,-1.7,;-6.18,-3.11,;-5.03,-4.14,;-5.03,-5.68,;-3.7,-6.45,;-2.37,-5.68,;-.9,-6.16,;0,-4.91,;-.9,-3.66,;-2.37,-4.14,;-3.7,-3.37,;4.4,2.78,;5.49,3.87,)|

BDBM198294

Fc1ccc(CNC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:11.14,wD:8.7,(7.52,2.88,;6.03,3.28,;4.94,2.19,;3.46,2.58,;3.06,4.07,;1.57,4.47,;.48,3.38,;-1.01,3.78,;-2.1,2.69,;-3.58,3.09,;-4.67,2,;-4.27,.51,;-2.79,.12,;-1.7,1.2,;-5.36,-.58,;-6.89,-.41,;-7.52,-1.82,;-6.38,-2.85,;-6.38,-4.39,;-5.04,-5.16,;-3.71,-4.39,;-2.24,-4.87,;-1.34,-3.62,;-2.24,-2.38,;-3.71,-2.85,;-5.04,-2.08,;4.15,5.16,;5.63,4.76,)|

BDBM198295

CN(C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)c1ccc(F)cc1 |r,wU:6.9,wD:3.2,(2.22,.61,;1.82,2.09,;.34,2.49,;-.75,1.4,;-2.24,1.8,;-3.33,.71,;-2.93,-.77,;-1.44,-1.17,;-.36,-.08,;-4.02,-1.86,;-5.55,-1.7,;-6.18,-3.11,;-5.03,-4.14,;-5.03,-5.68,;-3.7,-6.45,;-2.37,-5.68,;-.9,-6.16,;0,-4.91,;-.9,-3.66,;-2.37,-4.14,;-3.7,-3.37,;2.91,3.18,;2.51,4.67,;3.6,5.76,;5.09,5.36,;6.18,6.45,;5.49,3.87,;4.4,2.78,)|

BDBM198296

Cc1cc(ccc1NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)C#N |r,wU:12.16,wD:9.9,(.48,4.52,;1.97,4.13,;3.06,5.21,;4.55,4.82,;4.94,3.33,;3.85,2.24,;2.37,2.64,;1.28,1.55,;-.21,1.95,;-1.3,.86,;-2.79,1.26,;-3.87,.17,;-3.48,-1.32,;-1.99,-1.72,;-.9,-.63,;-4.57,-2.41,;-6.1,-2.25,;-6.72,-3.65,;-5.58,-4.68,;-5.58,-6.22,;-4.24,-6.99,;-2.91,-6.22,;-1.45,-6.7,;-.54,-5.45,;-1.45,-4.21,;-2.91,-4.68,;-4.24,-3.91,;5.63,5.91,;6.72,6.99,)|

BDBM198297

Cc1cc(OC(F)(F)F)ccc1NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:17.21,wD:14.14,(-.46,4.72,;1.03,4.33,;2.11,5.41,;3.6,5.02,;4.69,6.1,;6.18,5.71,;7.67,5.31,;6.58,4.22,;7.27,6.79,;4,3.53,;2.91,2.44,;1.42,2.84,;.34,1.75,;-1.15,2.15,;-2.24,1.06,;-3.73,1.46,;-4.82,.37,;-4.42,-1.12,;-2.93,-1.52,;-1.84,-.43,;-5.51,-2.21,;-7.04,-2.05,;-7.67,-3.45,;-6.52,-4.48,;-6.52,-6.02,;-5.19,-6.79,;-3.85,-6.02,;-2.39,-6.5,;-1.48,-5.25,;-2.39,-4.01,;-3.85,-4.48,;-5.19,-3.71,)|

BDBM198298

FC(F)(F)c1cc(NC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)ccc1C#N |r,wU:12.15,wD:9.8,(3.75,7.19,;2.66,6.1,;1.17,6.5,;2.26,7.59,;3.06,4.62,;1.97,3.53,;2.37,2.04,;1.28,.95,;-.21,1.35,;-1.3,.26,;-2.79,.66,;-3.87,-.43,;-3.48,-1.92,;-1.99,-2.32,;-.9,-1.23,;-4.57,-3.01,;-6.1,-2.84,;-6.72,-4.25,;-5.58,-5.28,;-5.58,-6.82,;-4.24,-7.59,;-2.91,-6.82,;-1.45,-7.3,;-.54,-6.05,;-1.45,-4.81,;-2.91,-5.28,;-4.24,-4.51,;3.85,1.64,;4.94,2.73,;4.55,4.22,;5.63,5.31,;6.72,6.4,)|

BDBM198299

Cc1ccc(CNC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)s1 |r,wU:11.14,wD:8.7,(7.2,4.93,;5.87,4.16,;5.39,2.7,;3.85,2.7,;3.38,4.16,;1.89,4.56,;.8,3.47,;-.69,3.87,;-1.78,2.78,;-3.26,3.18,;-4.35,2.09,;-3.95,.61,;-2.47,.21,;-1.38,1.3,;-5.04,-.48,;-6.58,-.32,;-7.2,-1.73,;-6.06,-2.76,;-6.06,-4.3,;-4.72,-5.07,;-3.39,-4.3,;-1.93,-4.78,;-1.02,-3.53,;-1.93,-2.28,;-3.39,-2.76,;-4.72,-1.99,;4.62,5.07,)|

BDBM198300

FCCNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:8.11,wD:5.4,(5.83,5.16,;4.74,4.07,;3.26,4.47,;2.17,3.38,;.68,3.78,;-.41,2.69,;-1.9,3.09,;-2.98,2,;-2.59,.51,;-1.1,.12,;-.01,1.2,;-3.68,-.58,;-5.21,-.41,;-5.83,-1.82,;-4.69,-2.85,;-4.69,-4.39,;-3.36,-5.16,;-2.02,-4.39,;-.56,-4.87,;.35,-3.62,;-.56,-2.38,;-2.02,-2.85,;-3.36,-2.08,)|

BDBM198301

CN(C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)c1ccc(cc1)C#N |r,wU:6.9,wD:3.2,(1.68,.06,;1.28,1.55,;-.21,1.95,;-1.3,.86,;-2.79,1.26,;-3.87,.17,;-3.48,-1.32,;-1.99,-1.72,;-.9,-.63,;-4.57,-2.41,;-6.1,-2.25,;-6.72,-3.65,;-5.58,-4.68,;-5.58,-6.22,;-4.24,-6.99,;-2.91,-6.22,;-1.45,-6.7,;-.54,-5.45,;-1.45,-4.21,;-2.91,-4.68,;-4.24,-3.91,;2.37,2.64,;1.97,4.13,;3.06,5.21,;4.55,4.82,;4.94,3.33,;3.85,2.24,;5.63,5.91,;6.72,6.99,)|

BDBM198302

CC(NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)c1ccc(F)c(F)c1 |r,wU:7.10,wD:4.3,(1.17,5.56,;1.57,4.07,;.48,2.98,;-1.01,3.38,;-2.1,2.29,;-3.58,2.69,;-4.67,1.6,;-4.27,.12,;-2.79,-.28,;-1.7,.81,;-5.36,-.97,;-6.89,-.81,;-7.52,-2.22,;-6.38,-3.25,;-6.38,-4.79,;-5.04,-5.56,;-3.71,-4.79,;-2.24,-5.27,;-1.34,-4.02,;-2.24,-2.77,;-3.71,-3.25,;-5.04,-2.48,;3.06,3.67,;4.15,4.76,;5.63,4.36,;6.03,2.88,;7.52,2.48,;4.94,1.79,;5.34,.3,;3.46,2.19,)|

BDBM198303

FC(F)(F)Oc1ccc(CNC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:15.18,wD:12.11,(5.89,.3,;6.98,1.39,;8.46,.99,;7.37,-.1,;6.58,2.88,;5.09,3.28,;4.69,4.76,;3.2,5.16,;2.11,4.07,;.63,4.47,;-.46,3.38,;-1.95,3.78,;-3.04,2.69,;-4.53,3.09,;-5.61,2,;-5.22,.51,;-3.73,.12,;-2.64,1.2,;-6.31,-.58,;-7.84,-.41,;-8.46,-1.82,;-7.32,-2.85,;-7.32,-4.39,;-5.99,-5.16,;-4.65,-4.39,;-3.19,-4.87,;-2.28,-3.62,;-3.19,-2.38,;-4.65,-2.85,;-5.99,-2.08,;2.51,2.58,;4,2.19,)|

BDBM198304

Fc1ccc(CCNC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:12.15,wD:9.8,(7.47,6.79,;6.38,5.71,;6.78,4.22,;5.69,3.13,;4.2,3.53,;3.11,2.44,;1.62,2.84,;.53,1.75,;-.95,2.15,;-2.04,1.06,;-3.53,1.46,;-4.62,.37,;-4.22,-1.12,;-2.73,-1.52,;-1.64,-.43,;-5.31,-2.21,;-6.84,-2.05,;-7.47,-3.45,;-6.32,-4.48,;-6.32,-6.02,;-4.99,-6.79,;-3.65,-6.02,;-2.19,-6.5,;-1.29,-5.25,;-2.19,-4.01,;-3.65,-4.48,;-4.99,-3.71,;3.8,5.02,;4.89,6.1,)|

BDBM198305

Fc1ccc(CNC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1C(F)(F)F |r,wU:11.14,wD:8.7,(7.52,2.88,;6.03,3.28,;5.63,4.76,;4.15,5.16,;3.06,4.07,;1.57,4.47,;.48,3.38,;-1.01,3.78,;-2.1,2.69,;-3.58,3.09,;-4.67,2,;-4.27,.51,;-2.79,.12,;-1.7,1.2,;-5.36,-.58,;-6.89,-.41,;-7.52,-1.82,;-6.38,-2.85,;-6.38,-4.39,;-5.04,-5.16,;-3.71,-4.39,;-2.24,-4.87,;-1.34,-3.62,;-2.24,-2.38,;-3.71,-2.85,;-5.04,-2.08,;3.46,2.58,;4.94,2.19,;5.34,.7,;6.83,.3,;4.25,-.39,;5.74,-.79,)|

BDBM198306

CS(=O)(=O)c1ccc(CNC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:14.17,wD:11.10,(8.06,3.97,;6.98,2.88,;6.58,1.39,;8.06,1.79,;5.49,3.28,;5.09,4.76,;3.6,5.16,;2.51,4.07,;1.03,4.47,;-.06,3.38,;-1.55,3.78,;-2.64,2.69,;-4.13,3.09,;-5.22,2,;-4.82,.51,;-3.33,.12,;-2.24,1.2,;-5.91,-.58,;-7.44,-.41,;-8.06,-1.82,;-6.92,-2.85,;-6.92,-4.39,;-5.59,-5.16,;-4.25,-4.39,;-2.79,-4.87,;-1.88,-3.62,;-2.79,-2.38,;-4.25,-2.85,;-5.59,-2.08,;2.91,2.58,;4.4,2.19,)|

BDBM198307

FC(F)(F)Oc1ccc(NC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:14.17,wD:11.10,(6.58,4.22,;6.18,5.71,;7.27,6.79,;7.67,5.31,;4.69,6.1,;3.6,5.02,;4,3.53,;2.91,2.44,;1.42,2.84,;.34,1.75,;-1.15,2.15,;-2.24,1.06,;-3.73,1.46,;-4.82,.37,;-4.42,-1.12,;-2.93,-1.52,;-1.84,-.43,;-5.51,-2.21,;-7.04,-2.05,;-7.67,-3.45,;-6.52,-4.48,;-6.52,-6.02,;-5.19,-6.79,;-3.85,-6.02,;-2.39,-6.5,;-1.48,-5.25,;-2.39,-4.01,;-3.85,-4.48,;-5.19,-3.71,;1.03,4.33,;2.11,5.41,)|

BDBM198308

FC(F)(F)Oc1ccc(NC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)c(Cl)c1 |r,wU:14.17,wD:11.10,(6.58,4.22,;6.18,5.71,;7.67,5.31,;7.27,6.79,;4.69,6.1,;3.6,5.02,;4,3.53,;2.91,2.44,;1.42,2.84,;.34,1.75,;-1.15,2.15,;-2.24,1.06,;-3.73,1.46,;-4.82,.37,;-4.42,-1.12,;-2.93,-1.52,;-1.84,-.43,;-5.51,-2.21,;-7.04,-2.05,;-7.67,-3.45,;-6.52,-4.48,;-6.52,-6.02,;-5.19,-6.79,;-3.85,-6.02,;-2.39,-6.5,;-1.48,-5.25,;-2.39,-4.01,;-3.85,-4.48,;-5.19,-3.71,;1.03,4.33,;-.46,4.72,;2.11,5.41,)|

BDBM198309

Fc1ccc(NC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)c(c1)C#N |r,wU:10.13,wD:7.6,(6.18,6.45,;5.09,5.36,;5.49,3.87,;4.4,2.78,;2.91,3.18,;1.82,2.09,;.34,2.49,;-.75,1.4,;-2.24,1.8,;-3.33,.71,;-2.93,-.77,;-1.44,-1.17,;-.36,-.08,;-4.02,-1.86,;-5.55,-1.7,;-6.18,-3.11,;-5.03,-4.14,;-5.03,-5.68,;-3.7,-6.45,;-2.37,-5.68,;-.9,-6.16,;0,-4.91,;-.9,-3.66,;-2.37,-4.14,;-3.7,-3.37,;2.51,4.67,;3.6,5.76,;1.03,5.07,;-.46,5.47,)|

BDBM198310

Fc1ccc(NC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)c(c1)C(F)(F)F |r,wU:10.13,wD:7.6,(6.18,6.4,;5.09,5.31,;5.49,3.82,;4.4,2.73,;2.91,3.13,;1.82,2.04,;.34,2.44,;-.75,1.35,;-2.24,1.75,;-3.33,.66,;-2.93,-.83,;-1.44,-1.23,;-.36,-.14,;-4.02,-1.92,;-5.55,-1.76,;-6.18,-3.16,;-5.03,-4.19,;-5.03,-5.73,;-3.7,-6.5,;-2.37,-5.73,;-.9,-6.21,;0,-4.96,;-.9,-3.72,;-2.37,-4.19,;-3.7,-3.42,;2.51,4.62,;3.6,5.71,;1.03,5.02,;.63,6.5,;-.06,3.93,;-.46,5.41,)|

BDBM198311

C(Nc1ccc(cc1)N1CCOCC1)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:17.22,wD:14.15,(-.95,1.2,;.53,.81,;1.62,1.89,;3.11,1.5,;4.2,2.58,;3.8,4.07,;2.31,4.47,;1.22,3.38,;4.89,5.16,;6.38,4.76,;7.47,5.85,;7.07,7.34,;5.58,7.74,;4.49,6.65,;-2.04,.12,;-3.53,.51,;-4.62,-.58,;-4.22,-2.06,;-2.73,-2.46,;-1.64,-1.37,;-5.31,-3.15,;-6.84,-2.99,;-7.47,-4.4,;-6.32,-5.43,;-6.32,-6.97,;-4.99,-7.74,;-3.65,-6.97,;-2.19,-7.44,;-1.29,-6.2,;-2.19,-4.95,;-3.65,-5.43,;-4.99,-4.66,)|

BDBM198312

O[C@H]1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:9.12,1.0,wD:6.5,(5.91,4.59,;4.58,3.82,;4.1,2.35,;2.56,2.35,;2.09,3.82,;.6,4.22,;-.49,3.13,;-1.98,3.53,;-3.07,2.44,;-2.67,.95,;-1.18,.55,;-.09,1.64,;-3.76,-.14,;-5.29,.02,;-5.91,-1.38,;-4.77,-2.41,;-4.77,-3.95,;-3.44,-4.72,;-2.1,-3.95,;-.64,-4.43,;.27,-3.18,;-.64,-1.94,;-2.1,-2.41,;-3.44,-1.64,;3.33,4.72,)|

BDBM198313

C(NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)[C@@H]1CCCO1 |r,wU:6.9,21.24,wD:3.2,(2.56,4.56,;1.47,3.47,;-.02,3.87,;-1.11,2.78,;-2.6,3.18,;-3.69,2.09,;-3.29,.61,;-1.8,.21,;-.71,1.3,;-4.38,-.48,;-5.91,-.32,;-6.53,-1.73,;-5.39,-2.76,;-5.39,-4.3,;-4.06,-5.07,;-2.72,-4.3,;-1.26,-4.78,;-.35,-3.53,;-1.26,-2.28,;-2.72,-2.76,;-4.06,-1.99,;4.04,4.16,;4.52,2.7,;6.06,2.7,;6.53,4.16,;5.29,5.07,)|

BDBM198314

N#Cc1ccc(NC2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |(6.98,2.13,;5.49,2.53,;4,2.93,;2.91,1.84,;1.42,2.24,;1.03,3.73,;-.46,4.13,;-1.55,3.04,;-1.15,1.55,;-2.24,.46,;-3.73,.86,;-4.13,2.35,;-3.04,3.44,;-4.82,-.23,;-6.35,-.07,;-6.98,-1.48,;-5.83,-2.51,;-5.83,-4.05,;-4.5,-4.82,;-3.16,-4.05,;-1.7,-4.52,;-.79,-3.28,;-1.7,-2.03,;-3.16,-2.51,;-4.5,-1.74,;2.11,4.82,;3.6,4.42,)|

BDBM198315

C(Cc1ccncc1)NC1CCC(CC1)c1nnn2cnc3[nH]ccc3c12 |(1.22,3.38,;2.31,4.47,;3.8,4.07,;4.2,2.58,;5.69,2.19,;6.78,3.28,;6.38,4.76,;4.89,5.16,;-.26,3.78,;-1.35,2.69,;-.95,1.2,;-2.04,.12,;-3.53,.51,;-3.93,2,;-2.84,3.09,;-4.62,-.58,;-6.15,-.41,;-6.78,-1.82,;-5.63,-2.85,;-5.63,-4.39,;-4.3,-5.16,;-2.96,-4.39,;-1.5,-4.87,;-.59,-3.62,;-1.5,-2.38,;-2.96,-2.85,;-4.3,-2.08,)|

BDBM198316

C(Cc1ccccc1)NC1CCC(CC1)c1nnn2cnc3[nH]ccc3c12 |(1.22,3.38,;2.31,4.47,;3.8,4.07,;4.2,2.58,;5.69,2.19,;6.78,3.28,;6.38,4.76,;4.89,5.16,;-.26,3.78,;-1.35,2.69,;-.95,1.2,;-2.04,.12,;-3.53,.51,;-3.93,2,;-2.84,3.09,;-4.62,-.58,;-6.15,-.41,;-6.78,-1.82,;-5.63,-2.85,;-5.63,-4.39,;-4.3,-5.16,;-2.96,-4.39,;-1.5,-4.87,;-.59,-3.62,;-1.5,-2.38,;-2.96,-2.85,;-4.3,-2.08,)|

BDBM198317

C1CN(CCO1)C1CCC(CC1)c1nnn2cnc3[nH]ccc3c12 |(4.55,3.87,;3.46,2.78,;1.97,3.18,;1.57,4.67,;2.66,5.76,;4.15,5.36,;.88,2.09,;1.28,.61,;.19,-.48,;-1.3,-.08,;-1.7,1.4,;-.61,2.49,;-2.39,-1.17,;-3.92,-1.01,;-4.55,-2.42,;-3.4,-3.45,;-3.4,-4.99,;-2.07,-5.76,;-.73,-4.99,;.73,-5.47,;1.64,-4.22,;.73,-2.97,;-.73,-3.45,;-2.07,-2.68,)|

BDBM198318

FC(F)(F)c1cccc(CCNC2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)c1 |(7.17,.3,;5.69,.7,;4.6,-.39,;6.09,-.79,;5.29,2.19,;6.38,3.28,;5.98,4.76,;4.49,5.16,;3.4,4.07,;1.92,4.47,;.83,3.38,;-.66,3.78,;-1.75,2.69,;-1.35,1.2,;-2.44,.12,;-3.93,.51,;-4.33,2,;-3.24,3.09,;-5.02,-.58,;-6.55,-.41,;-7.17,-1.82,;-6.03,-2.85,;-6.03,-4.39,;-4.7,-5.16,;-3.36,-4.39,;-1.9,-4.87,;-.99,-3.62,;-1.9,-2.38,;-3.36,-2.85,;-4.7,-2.08,;3.8,2.58,)|

BDBM198319

C(CN1CCOCC1)NC1CCC(CC1)c1nnn2cnc3[nH]ccc3c12 |(1.22,3.38,;2.31,4.47,;3.8,4.07,;4.2,2.58,;5.69,2.19,;6.78,3.28,;6.38,4.76,;4.89,5.16,;-.26,3.78,;-1.35,2.69,;-.95,1.2,;-2.04,.12,;-3.53,.51,;-3.93,2,;-2.84,3.09,;-4.62,-.58,;-6.15,-.41,;-6.78,-1.82,;-5.63,-2.85,;-5.63,-4.39,;-4.3,-5.16,;-2.96,-4.39,;-1.5,-4.87,;-.59,-3.62,;-1.5,-2.38,;-2.96,-2.85,;-4.3,-2.08,)|

BDBM198320

N#CC1CCN(CC1)C1CCC(CC1)c1nnn2cnc3[nH]ccc3c12 |(5.43,6.65,;4.35,5.56,;3.26,4.47,;3.66,2.98,;2.57,1.89,;1.08,2.29,;.68,3.78,;1.77,4.87,;-.01,1.2,;.39,-.28,;-.7,-1.37,;-2.19,-.97,;-2.59,.51,;-1.5,1.6,;-3.28,-2.06,;-4.81,-1.9,;-5.43,-3.31,;-4.29,-4.34,;-4.29,-5.88,;-2.96,-6.65,;-1.62,-5.88,;-.16,-6.35,;.75,-5.11,;-.16,-3.86,;-1.62,-4.34,;-2.96,-3.57,)|

BDBM198321

FC(F)(F)c1ccc(NC2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |(5.89,1.04,;5.49,2.53,;6.58,3.62,;6.98,2.13,;4,2.93,;2.91,1.84,;1.42,2.24,;1.03,3.73,;-.46,4.13,;-1.55,3.04,;-1.15,1.55,;-2.24,.46,;-3.73,.86,;-4.13,2.35,;-3.04,3.44,;-4.82,-.23,;-6.35,-.07,;-6.98,-1.48,;-5.83,-2.51,;-5.83,-4.05,;-4.5,-4.82,;-3.16,-4.05,;-1.7,-4.52,;-.79,-3.28,;-1.7,-2.03,;-3.16,-2.51,;-4.5,-1.74,;2.11,4.82,;3.6,4.42,)|

BDBM198322

Fc1cc(ccc1NC1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)C#N |(1.72,5.56,;2.11,4.07,;3.6,3.67,;4,2.19,;2.91,1.1,;1.42,1.5,;1.03,2.98,;-.46,3.38,;-1.55,2.29,;-1.15,.81,;-2.24,-.28,;-3.73,.12,;-4.13,1.6,;-3.04,2.69,;-4.82,-.97,;-6.35,-.81,;-6.98,-2.22,;-5.83,-3.25,;-5.83,-4.79,;-4.5,-5.56,;-3.16,-4.79,;-1.7,-5.27,;-.79,-4.02,;-1.7,-2.77,;-3.16,-3.25,;-4.5,-2.48,;5.49,1.79,;6.98,1.39,)|

BDBM198323

CN(C1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)c1ccc(F)cc1 |(-.12,5.21,;.28,3.73,;-.81,2.64,;-.41,1.15,;-1.5,.06,;-2.98,.46,;-3.38,1.95,;-2.29,3.04,;-4.07,-.63,;-5.61,-.47,;-6.23,-1.87,;-5.09,-2.9,;-5.09,-4.44,;-3.75,-5.21,;-2.42,-4.44,;-.96,-4.92,;-.05,-3.67,;-.96,-2.43,;-2.42,-2.9,;-3.75,-2.13,;1.77,3.33,;2.17,1.84,;3.66,1.44,;4.74,2.53,;6.23,2.13,;4.35,4.02,;2.86,4.42,)|

BDBM198324

Fc1ccc(NC2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |(6.23,2.53,;4.74,2.93,;3.66,1.84,;2.17,2.24,;1.77,3.73,;.28,4.13,;-.81,3.04,;-.41,1.55,;-1.5,.46,;-2.98,.86,;-3.38,2.35,;-2.29,3.44,;-4.07,-.23,;-5.61,-.07,;-6.23,-1.48,;-5.09,-2.51,;-5.09,-4.05,;-3.75,-4.82,;-2.42,-4.05,;-.96,-4.52,;-.05,-3.28,;-.96,-2.03,;-2.42,-2.51,;-3.75,-1.74,;2.86,4.82,;4.35,4.42,)|

BDBM198325

Cc1cc(ccc1NC1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)C#N |(1.72,5.56,;2.11,4.07,;3.6,3.67,;4,2.19,;2.91,1.1,;1.42,1.5,;1.03,2.98,;-.46,3.38,;-1.55,2.29,;-1.15,.81,;-2.24,-.28,;-3.73,.12,;-4.13,1.6,;-3.04,2.69,;-4.82,-.97,;-6.35,-.81,;-6.98,-2.22,;-5.83,-3.25,;-5.83,-4.79,;-4.5,-5.56,;-3.16,-4.79,;-1.7,-5.27,;-.79,-4.02,;-1.7,-2.77,;-3.16,-3.25,;-4.5,-2.48,;5.49,1.79,;6.98,1.39,)|

BDBM198326

Cc1cc(OC(F)(F)F)ccc1NC1CCC(CC1)c1nnn2cnc3[nH]ccc3c12 |(1.17,5.56,;1.57,4.07,;3.06,3.67,;3.46,2.19,;4.94,1.79,;6.03,2.88,;5.63,4.36,;7.52,2.48,;7.12,3.97,;2.37,1.1,;.88,1.5,;.48,2.98,;-1.01,3.38,;-2.1,2.29,;-1.7,.81,;-2.79,-.28,;-4.27,.12,;-4.67,1.6,;-3.58,2.69,;-5.36,-.97,;-6.89,-.81,;-7.52,-2.22,;-6.38,-3.25,;-6.38,-4.79,;-5.04,-5.56,;-3.71,-4.79,;-2.24,-5.27,;-1.34,-4.02,;-2.24,-2.77,;-3.71,-3.25,;-5.04,-2.48,)|

BDBM198327

N#Cc1ccc(N[C@H]2CC[C@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:10.13,7.6,(6.98,2.13,;5.49,2.53,;4,2.93,;2.91,1.84,;1.42,2.24,;1.03,3.73,;-.46,4.13,;-1.55,3.04,;-1.15,1.55,;-2.24,.46,;-3.73,.86,;-4.13,2.35,;-3.04,3.44,;-4.82,-.23,;-6.35,-.07,;-6.98,-1.48,;-5.83,-2.51,;-5.83,-4.05,;-4.5,-4.82,;-3.16,-4.05,;-1.7,-4.52,;-.79,-3.28,;-1.7,-2.03,;-3.16,-2.51,;-4.5,-1.74,;2.11,4.82,;3.6,4.42,)|

BDBM198328

N#Cc1ccc(N[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:10.13,wD:7.6,(6.98,2.13,;5.49,2.53,;4,2.93,;2.91,1.84,;1.42,2.24,;1.03,3.73,;-.46,4.13,;-1.55,3.04,;-3.04,3.44,;-4.13,2.35,;-3.73,.86,;-2.24,.46,;-1.15,1.55,;-4.82,-.23,;-6.35,-.07,;-6.98,-1.48,;-5.83,-2.51,;-5.83,-4.05,;-4.5,-4.82,;-3.16,-4.05,;-1.7,-4.52,;-.79,-3.28,;-1.7,-2.03,;-3.16,-2.51,;-4.5,-1.74,;2.11,4.82,;3.6,4.42,)|

BDBM198329

C(Cc1ccccc1)N[C@H]1CC[C@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:12.16,9.9,(1.22,3.38,;2.31,4.47,;3.8,4.07,;4.2,2.58,;5.69,2.19,;6.78,3.28,;6.38,4.76,;4.89,5.16,;-.26,3.78,;-1.35,2.69,;-.95,1.2,;-2.04,.12,;-3.53,.51,;-3.93,2,;-2.84,3.09,;-4.62,-.58,;-6.15,-.41,;-6.78,-1.82,;-5.63,-2.85,;-5.63,-4.39,;-4.3,-5.16,;-2.96,-4.39,;-1.5,-4.87,;-.59,-3.62,;-1.5,-2.38,;-2.96,-2.85,;-4.3,-2.08,)|

BDBM198330

C(Cc1ccccc1)N[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:12.16,wD:9.9,(1.22,3.38,;2.31,4.47,;3.8,4.07,;4.2,2.58,;5.69,2.19,;6.78,3.28,;6.38,4.76,;4.89,5.16,;-.26,3.78,;-1.35,2.69,;-2.84,3.09,;-3.93,2,;-3.53,.51,;-2.04,.12,;-.95,1.2,;-4.62,-.58,;-6.15,-.41,;-6.78,-1.82,;-5.63,-2.85,;-5.63,-4.39,;-4.3,-5.16,;-2.96,-4.39,;-1.5,-4.87,;-.59,-3.62,;-1.5,-2.38,;-2.96,-2.85,;-4.3,-2.08,)|

BDBM198331

C(CN[C@H]1CC[C@H](CC1)c1nnn2cnc3[nH]ccc3c12)Cc1ccccc1 |r,wU:6.9,3.2,(1.97,3.18,;.88,2.09,;-.61,2.49,;-1.7,1.4,;-1.3,-.08,;-2.39,-1.17,;-3.87,-.77,;-4.27,.71,;-3.18,1.8,;-4.96,-1.86,;-6.5,-1.7,;-7.12,-3.11,;-5.98,-4.14,;-5.98,-5.68,;-4.64,-6.45,;-3.31,-5.68,;-1.85,-6.16,;-.94,-4.91,;-1.85,-3.66,;-3.31,-4.14,;-4.64,-3.37,;3.46,2.78,;4.55,3.87,;6.03,3.47,;7.12,4.56,;6.72,6.05,;5.24,6.45,;4.15,5.36,)|

BDBM198332

C(CN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)Cc1ccccc1 |r,wU:6.9,wD:3.2,(1.97,3.18,;.88,2.09,;-.61,2.49,;-1.7,1.4,;-3.18,1.8,;-4.27,.71,;-3.87,-.77,;-2.39,-1.17,;-1.3,-.08,;-4.96,-1.86,;-6.5,-1.7,;-7.12,-3.11,;-5.98,-4.14,;-5.98,-5.68,;-4.64,-6.45,;-3.31,-5.68,;-1.85,-6.16,;-.94,-4.91,;-1.85,-3.66,;-3.31,-4.14,;-4.64,-3.37,;3.46,2.78,;4.55,3.87,;6.03,3.47,;7.12,4.56,;6.72,6.05,;5.24,6.45,;4.15,5.36,)|

BDBM198333

N#Cc1ccc(CN[C@H]2CC[C@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:11.14,8.7,(6.72,6.99,;5.63,5.91,;4.55,4.82,;3.06,5.21,;1.97,4.13,;2.37,2.64,;1.28,1.55,;-.21,1.95,;-1.3,.86,;-.9,-.63,;-1.99,-1.72,;-3.48,-1.32,;-3.87,.17,;-2.79,1.26,;-4.57,-2.41,;-6.1,-2.25,;-6.72,-3.65,;-5.58,-4.68,;-5.58,-6.22,;-4.24,-6.99,;-2.91,-6.22,;-1.45,-6.7,;-.54,-5.45,;-1.45,-4.21,;-2.91,-4.68,;-4.24,-3.91,;3.85,2.24,;4.94,3.33,)|

BDBM198334

N#Cc1ccc(CN[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:11.14,wD:8.7,(6.72,6.99,;5.63,5.91,;4.55,4.82,;3.06,5.21,;1.97,4.13,;2.37,2.64,;1.28,1.55,;-.21,1.95,;-1.3,.86,;-2.79,1.26,;-3.87,.17,;-3.48,-1.32,;-1.99,-1.72,;-.9,-.63,;-4.57,-2.41,;-6.1,-2.25,;-6.72,-3.65,;-5.58,-4.68,;-5.58,-6.22,;-4.24,-6.99,;-2.91,-6.22,;-1.45,-6.7,;-.54,-5.45,;-1.45,-4.21,;-2.91,-4.68,;-4.24,-3.91,;3.85,2.24,;4.94,3.33,)|

BDBM198335

FC(F)(F)c1ccc(CN[C@H]2CC[C@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:13.16,10.9,(5.04,7.19,;5.43,5.71,;6.92,5.31,;6.52,6.79,;4.35,4.62,;4.74,3.13,;3.66,2.04,;2.17,2.44,;1.08,1.35,;-.41,1.75,;-1.5,.66,;-1.1,-.83,;-2.19,-1.92,;-3.68,-1.52,;-4.07,-.03,;-2.98,1.06,;-4.76,-2.61,;-6.3,-2.45,;-6.92,-3.85,;-5.78,-4.88,;-5.78,-6.42,;-4.44,-7.19,;-3.11,-6.42,;-1.65,-6.9,;-.74,-5.65,;-1.65,-4.41,;-3.11,-4.88,;-4.44,-4.11,;1.77,3.93,;2.86,5.02,)|

BDBM198336

FC(F)(F)c1ccc(CN[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:13.16,wD:10.9,(6.52,6.79,;5.43,5.71,;5.04,7.19,;6.92,5.31,;4.35,4.62,;2.86,5.02,;1.77,3.93,;2.17,2.44,;1.08,1.35,;-.41,1.75,;-1.5,.66,;-2.98,1.06,;-4.07,-.03,;-3.68,-1.52,;-2.19,-1.92,;-1.1,-.83,;-4.76,-2.61,;-6.3,-2.45,;-6.92,-3.85,;-5.78,-4.88,;-5.78,-6.42,;-4.44,-7.19,;-3.11,-6.42,;-1.65,-6.9,;-.74,-5.65,;-1.65,-4.41,;-3.11,-4.88,;-4.44,-4.11,;3.66,2.04,;4.74,3.13,)|

BDBM198337

C1CN(CCO1)N[C@H]1CC[C@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:10.14,7.7,(4.4,1.84,;2.91,2.24,;2.51,3.73,;3.6,4.82,;5.09,4.42,;5.49,2.93,;1.03,4.13,;-.06,3.04,;.34,1.55,;-.75,.46,;-2.24,.86,;-2.64,2.35,;-1.55,3.44,;-3.33,-.23,;-4.86,-.07,;-5.49,-1.48,;-4.34,-2.51,;-4.34,-4.05,;-3.01,-4.82,;-1.68,-4.05,;-.21,-4.52,;.69,-3.28,;-.21,-2.03,;-1.68,-2.51,;-3.01,-1.74,)|

BDBM198338

C1CN(CCO1)N[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:10.14,wD:7.7,(4.4,1.84,;2.91,2.24,;2.51,3.73,;3.6,4.82,;5.09,4.42,;5.49,2.93,;1.03,4.13,;-.06,3.04,;-1.55,3.44,;-2.64,2.35,;-2.24,.86,;-.75,.46,;.34,1.55,;-3.33,-.23,;-4.86,-.07,;-5.49,-1.48,;-4.34,-2.51,;-4.34,-4.05,;-3.01,-4.82,;-1.68,-4.05,;-.21,-4.52,;.69,-3.28,;-.21,-2.03,;-1.68,-2.51,;-3.01,-1.74,)|

BDBM198339

OCc1ccc(cc1)-c1nnn2cnc3[nH]ccc3c12

BDBM198341

Fc1ccccc1CN1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198342

FC(F)(F)c1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)o1

BDBM198343

N#Cc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)s1

BDBM198344

Fc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cn1

BDBM198345

C(N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)c1ccco1

BDBM198346

Ic1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)o1

BDBM198347

C(N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)c1cccs1

BDBM198348

Brc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)o1

BDBM198349

Clc1ncc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)s1

BDBM198350

C(N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)c1ccn[nH]1

BDBM198351

C(N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)c1csnn1

BDBM198352

Brc1ncc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)s1

BDBM198353

Fc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1C(F)(F)F

BDBM198354

FC(F)(F)c1cc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)ccc1Cl

BDBM198355

CS(=O)(=O)c1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1

BDBM198356

Fc1cc(ccc1CN1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)C(F)(F)F

BDBM198357

Fc1cc(Cl)ccc1CN1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198358

Fc1cc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)ccc1Cl

BDBM198359

Clc1cc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)ccn1

BDBM198360

Fc1cnccc1CN1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198361

Fc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)nc1

BDBM198362

Clc1cnccc1CN1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198363

Fc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)c(F)c1

BDBM198364

Fc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)c(Cl)c1

BDBM198365

Fc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1F

BDBM198366

Fc1cc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)ccc1C(F)(F)F

BDBM198367

OCCOc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1

BDBM198368

FC(F)C(F)(F)Oc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1

BDBM198369

COc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cn1

BDBM198370

CC(C)(C)OC(=O)NCCN1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198371

OC(CNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)(c1ccccc1)C(F)(F)F |r,wU:8.11,wD:5.4,(3.06,1.3,;3.46,2.78,;1.97,3.18,;.88,2.09,;-.61,2.49,;-1.7,1.4,;-3.18,1.8,;-4.27,.71,;-3.87,-.77,;-2.39,-1.17,;-1.3,-.08,;-4.96,-1.86,;-6.5,-1.7,;-7.12,-3.11,;-5.98,-4.14,;-5.98,-5.68,;-4.64,-6.45,;-3.31,-5.68,;-1.85,-6.16,;-.94,-4.91,;-1.85,-3.66,;-3.31,-4.14,;-4.64,-3.37,;4.55,3.87,;6.03,3.47,;7.12,4.56,;6.72,6.05,;5.24,6.45,;4.15,5.36,;4.79,2.01,;4.79,.47,;6.12,2.78,;6.12,1.24,)|

BDBM198372

FC(F)(F)S(=O)(=O)c1ccc(NC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:16.19,wD:13.12,(6.58,3.82,;6.18,5.31,;7.27,6.4,;7.67,4.91,;4.69,5.71,;3.6,6.79,;5.09,7.19,;3.6,4.62,;4,3.13,;2.91,2.04,;1.42,2.44,;.34,1.35,;-1.15,1.75,;-2.24,.66,;-3.73,1.06,;-4.82,-.03,;-4.42,-1.52,;-2.93,-1.92,;-1.84,-.83,;-5.51,-2.61,;-7.04,-2.45,;-7.67,-3.85,;-6.52,-4.88,;-6.52,-6.42,;-5.19,-7.19,;-3.85,-6.42,;-2.39,-6.9,;-1.48,-5.65,;-2.39,-4.41,;-3.85,-4.88,;-5.19,-4.11,;1.03,3.93,;2.11,5.02,)|

BDBM198373

C(Cc1ccccc1)NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:13.17,wD:10.10,(1.97,3.18,;3.46,2.78,;4.55,3.87,;6.03,3.47,;7.12,4.56,;6.72,6.05,;5.24,6.45,;4.15,5.36,;.88,2.09,;-.61,2.49,;-1.7,1.4,;-3.18,1.8,;-4.27,.71,;-3.87,-.77,;-2.39,-1.17,;-1.3,-.08,;-4.96,-1.86,;-6.5,-1.7,;-7.12,-3.11,;-5.98,-4.14,;-5.98,-5.68,;-4.64,-6.45,;-3.31,-5.68,;-1.85,-6.16,;-.94,-4.91,;-1.85,-3.66,;-3.31,-4.14,;-4.64,-3.37,)|

BDBM198374

FC(F)(F)c1nc2cc(NC[C@H]3CC[C@@H](CC3)c3nnn4cnc5[nH]ccc5c34)ccc2[nH]1 |r,wU:14.17,wD:11.10,(7.91,4.33,;6.82,5.42,;7.22,6.9,;8.31,5.81,;5.33,5.02,;4.86,3.55,;3.32,3.55,;2.29,2.41,;.78,2.73,;-.31,1.64,;-1.8,2.04,;-2.88,.95,;-4.37,1.35,;-5.46,.26,;-5.06,-1.23,;-3.57,-1.63,;-2.49,-.54,;-6.15,-2.32,;-7.68,-2.16,;-8.31,-3.56,;-7.16,-4.59,;-7.16,-6.13,;-5.83,-6.9,;-4.5,-6.13,;-3.03,-6.61,;-2.13,-5.36,;-3.03,-4.12,;-4.5,-4.59,;-5.83,-3.82,;.31,4.19,;1.34,5.34,;2.84,5.02,;4.09,5.92,)|

BDBM198375

Clc1ccc(NC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:10.13,wD:7.6,(6.18,6.45,;5.09,5.36,;5.49,3.87,;4.4,2.78,;2.91,3.18,;1.82,2.09,;.34,2.49,;-.75,1.4,;-2.24,1.8,;-3.33,.71,;-2.93,-.77,;-1.44,-1.17,;-.36,-.08,;-4.02,-1.86,;-5.55,-1.7,;-6.18,-3.11,;-5.03,-4.14,;-5.03,-5.68,;-3.7,-6.45,;-2.37,-5.68,;-.9,-6.16,;0,-4.91,;-.9,-3.66,;-2.37,-4.14,;-3.7,-3.37,;2.51,4.67,;3.6,5.76,)|

BDBM198376

Clc1ccc(CNC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:11.14,wD:8.7,(7.52,2.88,;6.03,3.28,;4.94,2.19,;3.46,2.58,;3.06,4.07,;1.57,4.47,;.48,3.38,;-1.01,3.78,;-2.1,2.69,;-3.58,3.09,;-4.67,2,;-4.27,.51,;-2.79,.12,;-1.7,1.2,;-5.36,-.58,;-6.89,-.41,;-7.52,-1.82,;-6.38,-2.85,;-6.38,-4.39,;-5.04,-5.16,;-3.71,-4.39,;-2.24,-4.87,;-1.34,-3.62,;-2.24,-2.38,;-3.71,-2.85,;-5.04,-2.08,;4.15,5.16,;5.63,4.76,)|

BDBM198377

Clc1ccc(CCNC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:12.15,wD:9.8,(7.47,6.79,;6.38,5.71,;6.78,4.22,;5.69,3.13,;4.2,3.53,;3.11,2.44,;1.62,2.84,;.53,1.75,;-.95,2.15,;-2.04,1.06,;-3.53,1.46,;-4.62,.37,;-4.22,-1.12,;-2.73,-1.52,;-1.64,-.43,;-5.31,-2.21,;-6.84,-2.05,;-7.47,-3.45,;-6.32,-4.48,;-6.32,-6.02,;-4.99,-6.79,;-3.65,-6.02,;-2.19,-6.5,;-1.29,-5.25,;-2.19,-4.01,;-3.65,-4.48,;-4.99,-3.71,;3.8,5.02,;4.89,6.1,)|

BDBM198378

Fc1ccc2N(C[C@H]3CC[C@@H](CC3)c3nnn4cnc5[nH]ccc5c34)CCc2c1 |r,wU:10.13,wD:7.6,(6.57,5.94,;5.24,5.17,;3.91,5.94,;2.57,5.17,;2.57,3.63,;1.43,2.6,;-.06,3,;-1.15,1.91,;-2.64,2.31,;-3.73,1.22,;-3.33,-.27,;-1.84,-.67,;-.75,.42,;-4.42,-1.36,;-5.95,-1.19,;-6.57,-2.6,;-5.43,-3.63,;-5.43,-5.17,;-4.1,-5.94,;-2.76,-5.17,;-1.3,-5.65,;-.39,-4.4,;-1.3,-3.16,;-2.76,-3.63,;-4.1,-2.86,;2.05,1.19,;3.59,1.36,;3.91,2.86,;5.24,3.63,)|

BDBM198379

N#CCCN(CCC#N)C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:13.16,wD:10.9,(6.38,5.71,;5.29,4.62,;4.2,3.53,;2.71,3.93,;1.62,2.84,;2.02,1.35,;3.51,.95,;3.91,-.54,;4.31,-2.02,;.14,3.24,;-.95,2.15,;-2.44,2.55,;-3.53,1.46,;-3.13,-.03,;-1.64,-.43,;-.55,.66,;-4.22,-1.12,;-5.75,-.96,;-6.38,-2.37,;-5.23,-3.4,;-5.23,-4.94,;-3.9,-5.71,;-2.57,-4.94,;-1.1,-5.41,;-.2,-4.17,;-1.1,-2.92,;-2.57,-3.4,;-3.9,-2.63,)|

BDBM198380

CN(C)[C@H]1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:11.14,3.2,wD:8.7,(5.84,5.21,;5.45,3.73,;6.53,2.64,;3.96,3.33,;3.48,1.86,;1.94,1.86,;1.47,3.33,;-.02,3.73,;-1.11,2.64,;-2.6,3.04,;-3.69,1.95,;-3.29,.46,;-1.8,.06,;-.71,1.15,;-4.38,-.63,;-5.91,-.47,;-6.53,-1.87,;-5.39,-2.9,;-5.39,-4.44,;-4.06,-5.21,;-2.72,-4.44,;-1.26,-4.92,;-.35,-3.67,;-1.26,-2.43,;-2.72,-2.9,;-4.06,-2.13,;2.71,4.23,)|

BDBM198381

Cc1ccc(CNC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)o1 |r,wU:11.14,wD:8.7,(7.2,4.93,;5.87,4.16,;5.39,2.7,;3.85,2.7,;3.38,4.16,;1.89,4.56,;.8,3.47,;-.69,3.87,;-1.78,2.78,;-3.26,3.18,;-4.35,2.09,;-3.95,.61,;-2.47,.21,;-1.38,1.3,;-5.04,-.48,;-6.58,-.32,;-7.2,-1.73,;-6.06,-2.76,;-6.06,-4.3,;-4.72,-5.07,;-3.39,-4.3,;-1.93,-4.78,;-1.02,-3.53,;-1.93,-2.28,;-3.39,-2.76,;-4.72,-1.99,;4.62,5.07,)|

BDBM198382

Cc1cnc(CNC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cn1 |r,wU:11.14,wD:8.7,(7.52,2.88,;6.03,3.28,;5.63,4.76,;4.15,5.16,;3.06,4.07,;1.57,4.47,;.48,3.38,;-1.01,3.78,;-2.1,2.69,;-3.58,3.09,;-4.67,2,;-4.27,.51,;-2.79,.12,;-1.7,1.2,;-5.36,-.58,;-6.89,-.41,;-7.52,-1.82,;-6.38,-2.85,;-6.38,-4.39,;-5.04,-5.16,;-3.71,-4.39,;-2.24,-4.87,;-1.34,-3.62,;-2.24,-2.38,;-3.71,-2.85,;-5.04,-2.08,;3.46,2.58,;4.94,2.19,)|

BDBM198383

C[C@H](O)CNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:9.12,1.1,wD:6.5,(5.14,2.58,;4.74,4.07,;5.83,5.16,;3.26,4.47,;2.17,3.38,;.68,3.78,;-.41,2.69,;-1.9,3.09,;-2.98,2,;-2.59,.51,;-1.1,.12,;-.01,1.2,;-3.68,-.58,;-5.21,-.41,;-5.83,-1.82,;-4.69,-2.85,;-4.69,-4.39,;-3.36,-5.16,;-2.02,-4.39,;-.56,-4.87,;.35,-3.62,;-.56,-2.38,;-2.02,-2.85,;-3.36,-2.08,)|

BDBM198384

C[C@@H](O)CNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:9.12,wD:6.5,1.1,(5.14,2.58,;4.74,4.07,;5.83,5.16,;3.26,4.47,;2.17,3.38,;.68,3.78,;-.41,2.69,;-1.9,3.09,;-2.98,2,;-2.59,.51,;-1.1,.12,;-.01,1.2,;-3.68,-.58,;-5.21,-.41,;-5.83,-1.82,;-4.69,-2.85,;-4.69,-4.39,;-3.36,-5.16,;-2.02,-4.39,;-.56,-4.87,;.35,-3.62,;-.56,-2.38,;-2.02,-2.85,;-3.36,-2.08,)|

BDBM198385

OC(CNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)c1ccccc1 |r,wU:8.11,wD:5.4,(3.85,1.3,;3.46,2.78,;1.97,3.18,;.88,2.09,;-.61,2.49,;-1.7,1.4,;-3.18,1.8,;-4.27,.71,;-3.87,-.77,;-2.39,-1.17,;-1.3,-.08,;-4.96,-1.86,;-6.5,-1.7,;-7.12,-3.11,;-5.98,-4.14,;-5.98,-5.68,;-4.64,-6.45,;-3.31,-5.68,;-1.85,-6.16,;-.94,-4.91,;-1.85,-3.66,;-3.31,-4.14,;-4.64,-3.37,;4.55,3.87,;6.03,3.47,;7.12,4.56,;6.72,6.05,;5.24,6.45,;4.15,5.36,)|

BDBM198386

N#C[C@H]1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:10.13,2.1,wD:7.6,(6.73,4.62,;5.25,4.22,;3.76,3.82,;3.28,2.35,;1.74,2.35,;1.27,3.82,;-.22,4.22,;-1.31,3.13,;-2.8,3.53,;-3.89,2.44,;-3.49,.95,;-2,.55,;-.91,1.64,;-4.58,-.14,;-6.11,.02,;-6.73,-1.38,;-5.59,-2.41,;-5.59,-3.95,;-4.26,-4.72,;-2.92,-3.95,;-1.46,-4.43,;-.55,-3.18,;-1.46,-1.94,;-2.92,-2.41,;-4.26,-1.64,;2.51,4.72,)|

BDBM198387

FC(F)(F)CNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:10.13,wD:7.6,(4.94,2.58,;4.55,4.07,;5.63,5.16,;6.03,3.67,;3.06,4.47,;1.97,3.38,;.48,3.78,;-.61,2.69,;-2.1,3.09,;-3.18,2,;-2.79,.51,;-1.3,.12,;-.21,1.2,;-3.87,-.58,;-5.41,-.41,;-6.03,-1.82,;-4.89,-2.85,;-4.89,-4.39,;-3.55,-5.16,;-2.22,-4.39,;-.76,-4.87,;.15,-3.62,;-.76,-2.38,;-2.22,-2.85,;-3.55,-2.08,)|

BDBM198388

CS(=O)(=O)c1ccc2N(C[C@H]3CC[C@@H](CC3)c3nnn4cnc5[nH]ccc5c34)CCc2c1 |r,wU:13.16,wD:10.9,(7.24,4.51,;5.91,5.28,;5.14,6.61,;6.68,6.61,;4.57,4.51,;3.24,5.28,;1.91,4.51,;1.91,2.97,;.76,1.93,;-.73,2.33,;-1.82,1.24,;-3.3,1.64,;-4.39,.55,;-3.99,-.93,;-2.51,-1.33,;-1.42,-.24,;-5.08,-2.02,;-6.61,-1.86,;-7.24,-3.27,;-6.1,-4.3,;-6.1,-5.84,;-4.76,-6.61,;-3.43,-5.84,;-1.96,-6.31,;-1.06,-5.07,;-1.96,-3.82,;-3.43,-4.3,;-4.76,-3.53,;1.39,.53,;2.92,.69,;3.24,2.2,;4.57,2.97,)|

BDBM198389

CN(C)S(=O)(=O)c1ccc2N(C[C@H]3CC[C@@H](CC3)c3nnn4cnc5[nH]ccc5c34)CCc2c1 |r,wU:15.18,wD:12.11,(6.57,2.97,;6.57,4.51,;7.91,5.28,;5.24,5.28,;4.47,6.61,;6.01,6.61,;3.91,4.51,;2.57,5.28,;1.24,4.51,;1.24,2.97,;.09,1.93,;-1.39,2.33,;-2.48,1.24,;-3.97,1.64,;-5.06,.55,;-4.66,-.93,;-3.17,-1.33,;-2.08,-.24,;-5.75,-2.02,;-7.28,-1.86,;-7.91,-3.27,;-6.76,-4.3,;-6.76,-5.84,;-5.43,-6.61,;-4.1,-5.84,;-2.63,-6.31,;-1.73,-5.07,;-2.63,-3.82,;-4.1,-4.3,;-5.43,-3.53,;.72,.53,;2.25,.69,;2.57,2.2,;3.91,2.97,)|

BDBM198390

O=C1NCCN1CCNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:13.17,wD:10.10,(3.02,6.21,;4.35,5.44,;5.6,6.35,;6.84,5.44,;6.37,3.98,;4.83,3.98,;3.74,2.89,;2.25,3.29,;1.16,2.2,;-.33,2.6,;-1.42,1.51,;-2.9,1.91,;-3.99,.82,;-3.59,-.67,;-2.11,-1.07,;-1.02,.02,;-4.68,-1.76,;-6.21,-1.6,;-6.84,-3.01,;-5.7,-4.04,;-5.7,-5.58,;-4.36,-6.35,;-3.03,-5.58,;-1.56,-6.05,;-.66,-4.81,;-1.56,-3.56,;-3.03,-4.04,;-4.36,-3.27,)|

BDBM198391

C(Cc1c[nH]cn1)NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:12.16,wD:9.9,(2.25,3.29,;3.74,2.89,;4.83,3.98,;4.35,5.44,;5.6,6.35,;6.84,5.44,;6.37,3.98,;1.16,2.2,;-.33,2.6,;-1.42,1.51,;-2.9,1.91,;-3.99,.82,;-3.59,-.67,;-2.11,-1.07,;-1.02,.02,;-4.68,-1.76,;-6.21,-1.6,;-6.84,-3.01,;-5.7,-4.04,;-5.7,-5.58,;-4.36,-6.35,;-3.03,-5.58,;-1.56,-6.05,;-.66,-4.81,;-1.56,-3.56,;-3.03,-4.04,;-4.36,-3.27,)|

BDBM198392

C(NCc1ccccc1)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:12.16,wD:9.9,(-.26,3.78,;1.22,3.38,;2.31,4.47,;3.8,4.07,;4.2,2.58,;5.69,2.19,;6.78,3.28,;6.38,4.76,;4.89,5.16,;-1.35,2.69,;-2.84,3.09,;-3.93,2,;-3.53,.51,;-2.04,.12,;-.95,1.2,;-4.62,-.58,;-6.15,-.41,;-6.78,-1.82,;-5.63,-2.85,;-5.63,-4.39,;-4.3,-5.16,;-2.96,-4.39,;-1.5,-4.87,;-.59,-3.62,;-1.5,-2.38,;-2.96,-2.85,;-4.3,-2.08,)|

BDBM198393

C(N[C@H]1CC[C@H](CC1)c1nnn2cnc3[nH]ccc3c12)c1ccccc1 |r,wU:5.8,2.1,(2.17,2.44,;.68,2.84,;-.41,1.75,;-.01,.26,;-1.1,-.83,;-2.59,-.43,;-2.98,1.06,;-1.9,2.15,;-3.68,-1.52,;-5.21,-1.36,;-5.83,-2.76,;-4.69,-3.79,;-4.69,-5.33,;-3.36,-6.1,;-2.02,-5.33,;-.56,-5.81,;.35,-4.56,;-.56,-3.32,;-2.02,-3.79,;-3.36,-3.02,;3.26,3.53,;4.74,3.13,;5.83,4.22,;5.43,5.71,;3.95,6.1,;2.86,5.02,)|

BDBM198394

C(N[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)c1ccccc1 |r,wU:5.8,wD:2.1,(2.17,2.44,;.68,2.84,;-.41,1.75,;-1.9,2.15,;-2.98,1.06,;-2.59,-.43,;-1.1,-.83,;-.01,.26,;-3.68,-1.52,;-5.21,-1.36,;-5.83,-2.76,;-4.69,-3.79,;-4.69,-5.33,;-3.36,-6.1,;-2.02,-5.33,;-.56,-5.81,;.35,-4.56,;-.56,-3.32,;-2.02,-3.79,;-3.36,-3.02,;3.26,3.53,;4.74,3.13,;5.83,4.22,;5.43,5.71,;3.95,6.1,;2.86,5.02,)|

BDBM198395

Fc1ccc(CN[C@H]2CC[C@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:10.13,7.6,(6.18,6.45,;5.09,5.36,;5.49,3.87,;4.4,2.78,;2.91,3.18,;1.82,2.09,;.34,2.49,;-.75,1.4,;-.36,-.08,;-1.44,-1.17,;-2.93,-.77,;-3.33,.71,;-2.24,1.8,;-4.02,-1.86,;-5.55,-1.7,;-6.18,-3.11,;-5.03,-4.14,;-5.03,-5.68,;-3.7,-6.45,;-2.37,-5.68,;-.9,-6.16,;0,-4.91,;-.9,-3.66,;-2.37,-4.14,;-3.7,-3.37,;2.51,4.67,;3.6,5.76,)|

BDBM198396

Fc1ccc(CN[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:10.13,wD:7.6,(6.18,6.45,;5.09,5.36,;5.49,3.87,;4.4,2.78,;2.91,3.18,;1.82,2.09,;.34,2.49,;-.75,1.4,;-2.24,1.8,;-3.33,.71,;-2.93,-.77,;-1.44,-1.17,;-.36,-.08,;-4.02,-1.86,;-5.55,-1.7,;-6.18,-3.11,;-5.03,-4.14,;-5.03,-5.68,;-3.7,-6.45,;-2.37,-5.68,;-.9,-6.16,;0,-4.91,;-.9,-3.66,;-2.37,-4.14,;-3.7,-3.37,;2.51,4.67,;3.6,5.76,)|

BDBM198397

OC(CN[C@H]1CC[C@H](CC1)c1nnn2cnc3[nH]ccc3c12)(c1ccccc1)C(F)(F)F |r,wU:7.10,4.3,(1.22,4.57,;2.31,3.48,;1.22,2.39,;-.26,2.79,;-1.35,1.7,;-.95,.22,;-2.04,-.87,;-3.53,-.47,;-3.93,1.01,;-2.84,2.1,;-4.62,-1.56,;-6.15,-1.4,;-6.78,-2.81,;-5.63,-3.84,;-5.63,-5.38,;-4.3,-6.15,;-2.96,-5.38,;-1.5,-5.86,;-.59,-4.61,;-1.5,-3.36,;-2.96,-3.84,;-4.3,-3.07,;3.8,3.08,;4.2,1.6,;5.69,1.2,;6.78,2.29,;6.38,3.77,;4.89,4.17,;3.08,4.82,;4.62,4.82,;2.31,6.15,;3.85,6.15,)|

BDBM198398

OC(CN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)(c1ccccc1)C(F)(F)F |r,wU:7.10,wD:4.3,(1.22,4.57,;2.31,3.48,;1.22,2.39,;-.26,2.79,;-1.35,1.7,;-2.84,2.1,;-3.93,1.01,;-3.53,-.47,;-2.04,-.87,;-.95,.22,;-4.62,-1.56,;-6.15,-1.4,;-6.78,-2.81,;-5.63,-3.84,;-5.63,-5.38,;-4.3,-6.15,;-2.96,-5.38,;-1.5,-5.86,;-.59,-4.61,;-1.5,-3.36,;-2.96,-3.84,;-4.3,-3.07,;3.8,3.08,;4.2,1.6,;5.69,1.2,;6.78,2.29,;6.38,3.77,;4.89,4.17,;3.08,4.82,;4.62,4.82,;3.85,6.15,;2.31,6.15,)|

BDBM198399

Clc1ccc(CN[C@H]2CC[C@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:10.13,7.6,(6.18,6.45,;5.09,5.36,;5.49,3.87,;4.4,2.78,;2.91,3.18,;1.82,2.09,;.34,2.49,;-.75,1.4,;-.36,-.08,;-1.44,-1.17,;-2.93,-.77,;-3.33,.71,;-2.24,1.8,;-4.02,-1.86,;-5.55,-1.7,;-6.18,-3.11,;-5.03,-4.14,;-5.03,-5.68,;-3.7,-6.45,;-2.37,-5.68,;-.9,-6.16,;0,-4.91,;-.9,-3.66,;-2.37,-4.14,;-3.7,-3.37,;2.51,4.67,;3.6,5.76,)|

BDBM198400

Clc1ccc(CN[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:10.13,wD:7.6,(6.18,6.45,;5.09,5.36,;3.6,5.76,;2.51,4.67,;2.91,3.18,;1.82,2.09,;.34,2.49,;-.75,1.4,;-2.24,1.8,;-3.33,.71,;-2.93,-.77,;-1.44,-1.17,;-.36,-.08,;-4.02,-1.86,;-5.55,-1.7,;-6.18,-3.11,;-5.03,-4.14,;-5.03,-5.68,;-3.7,-6.45,;-2.37,-5.68,;-.9,-6.16,;0,-4.91,;-.9,-3.66,;-2.37,-4.14,;-3.7,-3.37,;4.4,2.78,;5.49,3.87,)|

BDBM198401

Clc1ccc(CCN[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:11.14,wD:8.7,(7.52,2.88,;6.03,3.28,;4.94,2.19,;3.46,2.58,;3.06,4.07,;1.57,4.47,;.48,3.38,;-1.01,3.78,;-2.1,2.69,;-3.58,3.09,;-4.67,2,;-4.27,.51,;-2.79,.12,;-1.7,1.2,;-5.36,-.58,;-6.89,-.41,;-7.52,-1.82,;-6.38,-2.85,;-6.38,-4.39,;-5.04,-5.16,;-3.71,-4.39,;-2.24,-4.87,;-1.34,-3.62,;-2.24,-2.38,;-3.71,-2.85,;-5.04,-2.08,;4.15,5.16,;5.63,4.76,)|

BDBM198402

OC(CN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)(c1ccc(Cl)cc1)C(F)(F)F |r,wU:7.10,wD:4.3,(.5,4.42,;1.59,3.33,;.5,2.24,;-.99,2.64,;-2.08,1.55,;-3.56,1.95,;-4.65,.86,;-4.26,-.63,;-2.77,-1.03,;-1.68,.06,;-5.34,-1.72,;-6.88,-1.56,;-7.5,-2.96,;-6.36,-3.99,;-6.36,-5.53,;-5.02,-6.3,;-3.69,-5.53,;-2.23,-6.01,;-1.32,-4.76,;-2.23,-3.52,;-3.69,-3.99,;-5.02,-3.22,;3.04,2.93,;3.44,1.44,;4.93,1.04,;6.01,2.13,;7.5,1.73,;5.62,3.62,;4.13,4.02,;1.99,4.82,;.9,5.91,;3.47,5.21,;2.39,6.3,)|

BDBM198403

OC(CN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)(c1ccc(F)cc1)C(F)(F)F |r,wU:7.10,wD:4.3,(.5,4.57,;1.59,3.48,;.5,2.39,;-.99,2.79,;-2.08,1.7,;-3.56,2.1,;-4.65,1.01,;-4.26,-.47,;-2.77,-.87,;-1.68,.22,;-5.34,-1.56,;-6.88,-1.4,;-7.5,-2.81,;-6.36,-3.84,;-6.36,-5.38,;-5.02,-6.15,;-3.69,-5.38,;-2.23,-5.86,;-1.32,-4.61,;-2.23,-3.36,;-3.69,-3.84,;-5.02,-3.07,;3.04,3.08,;3.44,1.6,;4.93,1.2,;6.01,2.29,;7.5,1.89,;5.62,3.77,;4.13,4.17,;2.36,4.82,;1.59,6.15,;3.9,4.82,;3.13,6.15,)|

BDBM198404

Fc1ccc(CCN[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:11.14,wD:8.7,(7.52,2.88,;6.03,3.28,;4.94,2.19,;3.46,2.58,;3.06,4.07,;1.57,4.47,;.48,3.38,;-1.01,3.78,;-2.1,2.69,;-3.58,3.09,;-4.67,2,;-4.27,.51,;-2.79,.12,;-1.7,1.2,;-5.36,-.58,;-6.89,-.41,;-7.52,-1.82,;-6.38,-2.85,;-6.38,-4.39,;-5.04,-5.16,;-3.71,-4.39,;-2.24,-4.87,;-1.34,-3.62,;-2.24,-2.38,;-3.71,-2.85,;-5.04,-2.08,;4.15,5.16,;5.63,4.76,)|

BDBM198405

OC(CN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)c1ccccc1 |r,wU:7.10,wD:4.3,(1.93,5.56,;2.33,4.07,;1.24,2.98,;-.24,3.38,;-1.33,2.29,;-2.82,2.69,;-3.91,1.6,;-3.51,.12,;-2.02,-.28,;-.94,.81,;-4.6,-.97,;-6.13,-.81,;-6.76,-2.22,;-5.61,-3.25,;-5.61,-4.79,;-4.28,-5.56,;-2.95,-4.79,;-1.48,-5.27,;-.58,-4.02,;-1.48,-2.77,;-2.95,-3.25,;-4.28,-2.48,;3.78,3.67,;4.18,2.19,;5.67,1.79,;6.76,2.88,;6.36,4.36,;4.87,4.76,)|

BDBM198406

O[C@H](CN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)c1ccccc1 |r,wU:7.10,1.0,wD:4.3,(1.93,5.56,;2.33,4.07,;1.24,2.98,;-.24,3.38,;-1.33,2.29,;-2.82,2.69,;-3.91,1.6,;-3.51,.12,;-2.02,-.28,;-.94,.81,;-4.6,-.97,;-6.13,-.81,;-6.76,-2.22,;-5.61,-3.25,;-5.61,-4.79,;-4.28,-5.56,;-2.95,-4.79,;-1.48,-5.27,;-.58,-4.02,;-1.48,-2.77,;-2.95,-3.25,;-4.28,-2.48,;3.78,3.67,;4.18,2.19,;5.67,1.79,;6.76,2.88,;6.36,4.36,;4.87,4.76,)|

BDBM198407

O[C@@H](CN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)c1ccccc1 |r,wU:7.10,wD:4.3,1.0,(1.92,5.56,;2.31,4.07,;1.22,2.98,;-.26,3.38,;-1.35,2.29,;-2.84,2.69,;-3.93,1.6,;-3.53,.12,;-2.04,-.28,;-.95,.81,;-4.62,-.97,;-6.15,-.81,;-6.78,-2.22,;-5.63,-3.25,;-5.63,-4.79,;-4.3,-5.56,;-2.96,-4.79,;-1.5,-5.27,;-.59,-4.02,;-1.5,-2.77,;-2.96,-3.25,;-4.3,-2.48,;3.8,3.67,;4.2,2.19,;5.69,1.79,;6.78,2.88,;6.38,4.36,;4.89,4.76,)|

BDBM198408

Clc1ccc(NC2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |(6.23,2.53,;4.74,2.93,;3.66,1.84,;2.17,2.24,;1.77,3.73,;.28,4.13,;-.81,3.04,;-.41,1.55,;-1.5,.46,;-2.98,.86,;-3.38,2.35,;-2.29,3.44,;-4.07,-.23,;-5.61,-.07,;-6.23,-1.48,;-5.09,-2.51,;-5.09,-4.05,;-3.75,-4.82,;-2.42,-4.05,;-.96,-4.52,;-.05,-3.28,;-.96,-2.03,;-2.42,-2.51,;-3.75,-1.74,;2.86,4.82,;4.35,4.42,)|

BDBM198409

Fc1ccc(NC(=O)[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:11.14,wD:8.7,(6.18,6.45,;5.09,5.36,;5.49,3.87,;4.4,2.78,;2.91,3.18,;1.82,2.09,;.34,2.49,;-.06,3.98,;-.75,1.4,;-2.24,1.8,;-3.33,.71,;-2.93,-.77,;-1.44,-1.17,;-.36,-.08,;-4.02,-1.86,;-5.55,-1.7,;-6.18,-3.11,;-5.03,-4.14,;-5.03,-5.68,;-3.7,-6.45,;-2.37,-5.68,;-.9,-6.16,;0,-4.91,;-.9,-3.66,;-2.37,-4.14,;-3.7,-3.37,;2.51,4.67,;3.6,5.76,)|

BDBM198410

Fc1ccc(CNC(=O)[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:12.15,wD:9.8,(7.52,2.82,;6.03,3.22,;4.94,2.13,;3.46,2.53,;3.06,4.02,;1.57,4.42,;.48,3.33,;-1.01,3.73,;-1.41,5.21,;-2.1,2.64,;-3.58,3.04,;-4.67,1.95,;-4.27,.46,;-2.79,.06,;-1.7,1.15,;-5.36,-.63,;-6.89,-.47,;-7.52,-1.87,;-6.38,-2.9,;-6.38,-4.44,;-5.04,-5.21,;-3.71,-4.44,;-2.24,-4.92,;-1.34,-3.67,;-2.24,-2.43,;-3.71,-2.9,;-5.04,-2.13,;4.15,5.11,;5.63,4.71,)|

BDBM198411

Fc1ccc(CCNC(=O)[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:13.16,wD:10.9,(7.47,6.79,;6.38,5.71,;6.78,4.22,;5.69,3.13,;4.2,3.53,;3.11,2.44,;1.62,2.84,;.53,1.75,;-.95,2.15,;-1.35,3.63,;-2.04,1.06,;-3.53,1.46,;-4.62,.37,;-4.22,-1.12,;-2.73,-1.52,;-1.64,-.43,;-5.31,-2.21,;-6.84,-2.05,;-7.47,-3.45,;-6.32,-4.48,;-6.32,-6.02,;-4.99,-6.79,;-3.65,-6.02,;-2.19,-6.5,;-1.29,-5.25,;-2.19,-4.01,;-3.65,-4.48,;-4.99,-3.71,;3.8,5.02,;4.89,6.1,)|

BDBM198412

F[C@H]1CCN(C1)C(=O)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:11.15,1.0,wD:8.8,(5.91,4.1,;4.58,3.33,;4.1,1.86,;2.56,1.86,;2.09,3.33,;3.33,4.23,;.6,3.73,;.2,5.21,;-.49,2.64,;-1.98,3.04,;-3.07,1.95,;-2.67,.46,;-1.18,.06,;-.09,1.15,;-3.76,-.63,;-5.29,-.47,;-5.91,-1.87,;-4.77,-2.9,;-4.77,-4.44,;-3.44,-5.21,;-2.1,-4.44,;-.64,-4.92,;.27,-3.67,;-.64,-2.43,;-2.1,-2.9,;-3.44,-2.13,)|

BDBM198413

N#Cc1ccc(CN2CCC(CC2)c2ncn3cnc4[nH]ccc4c23)cc1

BDBM198414

O=C(OCc1ccccc1)N1CCC(C1)c1nnn2cnc3[nH]ccc3c12

BDBM198415

OC(CN1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)c1ccc(cc1)C(F)(F)F

BDBM198416

N#CCOc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1

BDBM198417

Clc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cn1

BDBM198418

C(\C=C\c1ccco1)N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198419

CN1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198420

Clc1n[nH]c2ccc(CN3CCC(CC3)c3nnn4cnc5[nH]ccc5c34)cc12

BDBM198421

C(N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)c1ccc2nccnc2c1

BDBM198422

C(N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)c1cocn1

BDBM198423

FC(F)Oc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1

BDBM198424

C(N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)c1ccc(cc1)-n1ccnc1

BDBM198425

Fc1cc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)ccc1C#N

BDBM198426

Fc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1C#N

BDBM198427

Fc1cc(cc(F)c1CN1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)C(F)(F)F

BDBM198428

O=C1COc2ccc(CN3CCC(CC3)c3nnn4cnc5[nH]ccc5c34)cc2N1

BDBM198429

CN(CCC#N)c1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1

BDBM198430

FC1(F)Oc2ccc(CN3CCC(CC3)c3nnn4cnc5[nH]ccc5c34)cc2O1

BDBM198431

Clc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)o1

BDBM198432

FC1(F)Oc2cccc(CN3CCC(CC3)c3nnn4cnc5[nH]ccc5c34)c2O1

BDBM198433

N#C\C(=C/N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)c1ccccc1

BDBM198434

Clc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)c(Cl)n1

BDBM198435

c6ccc5sc(CN4CCC(c2nnn3cnc1[nH]ccc1c23)CC4)cc5c6

BDBM198436

Brc1cc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)sc1Br

BDBM198437

C(N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)c1cnc(s1)N1CCOCC1

BDBM198438

Clc1ccc(cc1)C(=C\N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)\C#N

BDBM198439

Cc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)s1

BDBM198440

Brc1csc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)c1

BDBM198441

Brc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)s1

BDBM198442

C(N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)c1ccncc1

BDBM198443

C(N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)c1cscn1

BDBM198444

NC(=O)c1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1

BDBM198445

N#Cc1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1C#N

BDBM198446

FC(F)(F)c1ccc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1C#N

BDBM198447

FC(F)(F)c1cc(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)ccc1C#N

BDBM198448

CC(N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)c1ccccc1

BDBM198449

N#CCN1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198450

Clc1cc(NC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)ccc1C#N |r,wU:9.12,wD:6.5,(2.66,6.7,;3.06,5.21,;1.97,4.13,;2.37,2.64,;1.28,1.55,;-.21,1.95,;-1.3,.86,;-2.79,1.26,;-3.87,.17,;-3.48,-1.32,;-1.99,-1.72,;-.9,-.63,;-4.57,-2.41,;-6.1,-2.25,;-6.72,-3.65,;-5.58,-4.68,;-5.58,-6.22,;-4.24,-6.99,;-2.91,-6.22,;-1.45,-6.7,;-.54,-5.45,;-1.45,-4.21,;-2.91,-4.68,;-4.24,-3.91,;3.85,2.24,;4.94,3.33,;4.55,4.82,;5.63,5.91,;6.72,6.99,)|

BDBM198451

N#Cc1ccc(NC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)c2ccccc12 |r,wU:11.14,wD:8.7,(6.67,6.99,;5.58,5.91,;4.49,4.82,;3,5.21,;1.92,4.13,;2.31,2.64,;1.22,1.55,;-.26,1.95,;-1.35,.86,;-2.84,1.26,;-3.93,.17,;-3.53,-1.32,;-2.04,-1.72,;-.95,-.63,;-4.62,-2.41,;-6.15,-2.25,;-6.78,-3.65,;-5.63,-4.68,;-5.63,-6.22,;-4.3,-6.99,;-2.96,-6.22,;-1.5,-6.7,;-.59,-5.45,;-1.5,-4.21,;-2.96,-4.68,;-4.3,-3.91,;3.8,2.24,;4.2,.75,;5.69,.35,;6.78,1.44,;6.38,2.93,;4.89,3.33,)|

BDBM198452

Fc1ccc(NC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1F |r,wU:10.13,wD:7.6,(5.78,6.45,;4.69,5.36,;3.2,5.76,;2.11,4.67,;2.51,3.18,;1.42,2.09,;-.06,2.49,;-1.15,1.4,;-2.64,1.8,;-3.73,.71,;-3.33,-.77,;-1.84,-1.17,;-.75,-.08,;-4.42,-1.86,;-5.95,-1.7,;-6.58,-3.11,;-5.43,-4.14,;-5.43,-5.68,;-4.1,-6.45,;-2.77,-5.68,;-1.3,-6.16,;-.4,-4.91,;-1.3,-3.66,;-2.77,-4.14,;-4.1,-3.37,;4,2.78,;5.09,3.87,;6.58,3.47,)|

BDBM198453

Fc1cc(NC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc(F)c1F |r,wU:9.12,wD:6.5,(6.58,3.08,;5.09,3.47,;4,2.39,;2.51,2.78,;1.42,1.7,;-.06,2.09,;-1.15,1.01,;-2.64,1.4,;-3.73,.31,;-3.33,-1.17,;-1.84,-1.57,;-.75,-.48,;-4.42,-2.26,;-5.95,-2.1,;-6.58,-3.51,;-5.43,-4.54,;-5.43,-6.08,;-4.1,-6.85,;-2.77,-6.08,;-1.3,-6.55,;-.4,-5.31,;-1.3,-4.06,;-2.77,-4.54,;-4.1,-3.77,;2.11,4.27,;3.2,5.36,;2.8,6.85,;4.69,4.96,;5.78,6.05,)|

BDBM198454

Fc1ccc(NC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1C(F)(F)F |r,wU:10.13,wD:7.6,(5.04,6.45,;3.95,5.36,;2.46,5.76,;1.37,4.67,;1.77,3.18,;.68,2.09,;-.81,2.49,;-1.9,1.4,;-3.38,1.8,;-4.47,.71,;-4.07,-.77,;-2.59,-1.17,;-1.5,-.08,;-5.16,-1.86,;-6.69,-1.7,;-7.32,-3.11,;-6.18,-4.14,;-6.18,-5.68,;-4.84,-6.45,;-3.51,-5.68,;-2.04,-6.16,;-1.14,-4.91,;-2.04,-3.66,;-3.51,-4.14,;-4.84,-3.37,;3.26,2.78,;4.35,3.87,;5.83,3.47,;6.92,4.56,;6.23,1.99,;7.32,3.08,)|

BDBM198455

Fc1ccc(NC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1C#N |r,wU:10.13,wD:7.6,(5.04,6.45,;3.95,5.36,;2.46,5.76,;1.37,4.67,;1.77,3.18,;.68,2.09,;-.81,2.49,;-1.9,1.4,;-3.38,1.8,;-4.47,.71,;-4.07,-.77,;-2.59,-1.17,;-1.5,-.08,;-5.16,-1.86,;-6.69,-1.7,;-7.32,-3.11,;-6.18,-4.14,;-6.18,-5.68,;-4.84,-6.45,;-3.51,-5.68,;-2.04,-6.16,;-1.14,-4.91,;-2.04,-3.66,;-3.51,-4.14,;-4.84,-3.37,;3.26,2.78,;4.35,3.87,;5.83,3.47,;7.32,3.08,)|

BDBM198456

O=C1SCCC1NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:11.15,wD:8.8,(5.7,2.3,;4.93,3.63,;5.41,5.1,;4.16,6,;2.91,5.1,;3.39,3.63,;2.3,2.54,;.81,2.94,;-.28,1.85,;-1.76,2.25,;-2.85,1.16,;-2.45,-.33,;-.97,-.72,;.12,.36,;-3.54,-1.41,;-5.07,-1.25,;-5.7,-2.66,;-4.56,-3.69,;-4.56,-5.23,;-3.22,-6,;-1.89,-5.23,;-.42,-5.71,;.48,-4.46,;-.42,-3.22,;-1.89,-3.69,;-3.22,-2.92,)|

BDBM198457

C([C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)N1CCSC1 |r,wU:4.7,wD:1.0,(1.33,4.05,;.24,2.96,;-1.25,3.36,;-2.34,2.27,;-1.94,.78,;-.45,.38,;.64,1.47,;-3.03,-.31,;-4.56,-.15,;-5.19,-1.55,;-4.04,-2.58,;-4.04,-4.12,;-2.71,-4.89,;-1.37,-4.12,;.09,-4.6,;1,-3.35,;.09,-2.11,;-1.37,-2.58,;-2.71,-1.81,;2.82,3.65,;3.72,4.89,;5.19,4.42,;5.19,2.88,;3.72,2.4,)|

BDBM198458

FC(F)CNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:9.12,wD:6.5,(5.83,5.16,;4.74,4.07,;5.14,2.58,;3.26,4.47,;2.17,3.38,;.68,3.78,;-.41,2.69,;-1.9,3.09,;-2.98,2,;-2.59,.51,;-1.1,.12,;-.01,1.2,;-3.68,-.58,;-5.21,-.41,;-5.83,-1.82,;-4.69,-2.85,;-4.69,-4.39,;-3.36,-5.16,;-2.02,-4.39,;-.56,-4.87,;.35,-3.62,;-.56,-2.38,;-2.02,-2.85,;-3.36,-2.08,)|

BDBM198459

FC(F)(F)CCNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:11.14,wD:8.7,(4.69,5.91,;5.09,4.42,;6.58,4.02,;6.18,5.51,;4,3.33,;2.51,3.73,;1.42,2.64,;-.06,3.04,;-1.15,1.95,;-2.64,2.35,;-3.73,1.26,;-3.33,-.23,;-1.84,-.63,;-.75,.46,;-4.42,-1.32,;-5.95,-1.16,;-6.58,-2.56,;-5.43,-3.6,;-5.43,-5.14,;-4.1,-5.91,;-2.77,-5.14,;-1.3,-5.61,;-.4,-4.37,;-1.3,-3.12,;-2.77,-3.6,;-4.1,-2.83,)|

BDBM198460

OC1CN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:8.11,wD:5.4,(5.8,2.92,;4.31,3.32,;2.98,2.55,;2.21,3.89,;.72,4.29,;-.37,3.2,;-1.86,3.6,;-2.95,2.51,;-2.55,1.02,;-1.06,.62,;.03,1.71,;-3.64,-.07,;-5.17,.09,;-5.8,-1.32,;-4.65,-2.35,;-4.65,-3.89,;-3.32,-4.66,;-1.98,-3.89,;-.52,-4.36,;.39,-3.12,;-.52,-1.87,;-1.98,-2.35,;-3.32,-1.58,;3.54,4.66,)|

BDBM198461

FC(F)(F)C1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)CC1 |r,wU:12.15,wD:9.8,(6.58,3.62,;5.49,2.53,;5.89,1.04,;6.98,2.13,;4,2.93,;2.91,1.84,;1.42,2.24,;1.03,3.73,;-.46,4.13,;-1.55,3.04,;-3.04,3.44,;-4.13,2.35,;-3.73,.86,;-2.24,.46,;-1.15,1.55,;-4.82,-.23,;-6.35,-.07,;-6.98,-1.48,;-5.83,-2.51,;-5.83,-4.05,;-4.5,-4.82,;-3.16,-4.05,;-1.7,-4.52,;-.79,-3.28,;-1.7,-2.03,;-3.16,-2.51,;-4.5,-1.74,;2.11,4.82,;3.6,4.42,)|

BDBM198462

N#CCNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:8.11,wD:5.4,(6.03,4.02,;4.55,4.42,;3.06,4.82,;1.97,3.73,;.48,4.13,;-.61,3.04,;-2.1,3.44,;-3.18,2.35,;-2.79,.86,;-1.3,.46,;-.21,1.55,;-3.87,-.23,;-5.41,-.07,;-6.03,-1.48,;-4.89,-2.51,;-4.89,-4.05,;-3.55,-4.82,;-2.22,-4.05,;-.76,-4.52,;.15,-3.28,;-.76,-2.03,;-2.22,-2.51,;-3.55,-1.74,)|

BDBM198463

O=C1CN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)CCN1 |r,wU:8.11,wD:5.4,(5.83,5.16,;4.74,4.07,;3.26,4.47,;2.17,3.38,;.68,3.78,;-.41,2.69,;-1.9,3.09,;-2.98,2,;-2.59,.51,;-1.1,.12,;-.01,1.2,;-3.68,-.58,;-5.21,-.41,;-5.83,-1.82,;-4.69,-2.85,;-4.69,-4.39,;-3.36,-5.16,;-2.02,-4.39,;-.56,-4.87,;.35,-3.62,;-.56,-2.38,;-2.02,-2.85,;-3.36,-2.08,;2.57,1.89,;4.05,1.5,;5.14,2.58,)|

BDBM198464

NC(=O)C1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)CC1 |r,wU:11.14,wD:8.7,(6.78,3.62,;5.69,2.53,;6.09,1.04,;4.2,2.93,;3.11,1.84,;1.62,2.24,;1.22,3.73,;-.26,4.13,;-1.35,3.04,;-2.84,3.44,;-3.93,2.35,;-3.53,.86,;-2.04,.46,;-.95,1.55,;-4.62,-.23,;-6.15,-.07,;-6.78,-1.48,;-5.63,-2.51,;-5.63,-4.05,;-4.3,-4.82,;-2.96,-4.05,;-1.5,-4.52,;-.59,-3.28,;-1.5,-2.03,;-2.96,-2.51,;-4.3,-1.74,;2.31,4.82,;3.8,4.42,)|

BDBM198465

N#Cc1ccc(NC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1C#N |r,wU:11.14,wD:8.7,(6.13,6.99,;5.04,5.91,;3.95,4.82,;2.46,5.21,;1.37,4.13,;1.77,2.64,;.68,1.55,;-.81,1.95,;-1.9,.86,;-3.38,1.26,;-4.47,.17,;-4.07,-1.32,;-2.59,-1.72,;-1.5,-.63,;-5.16,-2.41,;-6.69,-2.25,;-7.32,-3.65,;-6.18,-4.68,;-6.18,-6.22,;-4.84,-6.99,;-3.51,-6.22,;-2.04,-6.7,;-1.14,-5.45,;-2.04,-4.21,;-3.51,-4.68,;-4.84,-3.91,;3.26,2.24,;4.35,3.33,;5.83,2.93,;7.32,2.53,)|

BDBM198466

Clc1ccc(NC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1C#N |r,wU:10.13,wD:7.6,(5.04,6.45,;3.95,5.36,;2.46,5.76,;1.37,4.67,;1.77,3.18,;.68,2.09,;-.81,2.49,;-1.9,1.4,;-3.38,1.8,;-4.47,.71,;-4.07,-.77,;-2.59,-1.17,;-1.5,-.08,;-5.16,-1.86,;-6.69,-1.7,;-7.32,-3.11,;-6.18,-4.14,;-6.18,-5.68,;-4.84,-6.45,;-3.51,-5.68,;-2.04,-6.16,;-1.14,-4.91,;-2.04,-3.66,;-3.51,-4.14,;-4.84,-3.37,;3.26,2.78,;4.35,3.87,;5.83,3.47,;7.32,3.08,)|

BDBM198467

N#CCc1ccc(NC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:12.15,wD:9.8,(7.67,5.65,;6.18,6.05,;4.69,6.45,;3.6,5.36,;4,3.87,;2.91,2.78,;1.42,3.18,;.34,2.09,;-1.15,2.49,;-2.24,1.4,;-3.73,1.8,;-4.82,.71,;-4.42,-.77,;-2.93,-1.17,;-1.84,-.08,;-5.51,-1.86,;-7.04,-1.7,;-7.67,-3.11,;-6.52,-4.14,;-6.52,-5.68,;-5.19,-6.45,;-3.85,-5.68,;-2.39,-6.16,;-1.48,-4.91,;-2.39,-3.66,;-3.85,-4.14,;-5.19,-3.37,;1.03,4.67,;2.11,5.76,)|

BDBM198468

OC[C@H]1CCCN1C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:11.15,2.1,wD:8.8,(4.41,6.18,;3.32,5.09,;3.72,3.61,;5.19,3.13,;5.19,1.59,;3.72,1.11,;2.82,2.36,;1.33,2.76,;.24,1.67,;-1.25,2.07,;-2.34,.98,;-1.94,-.51,;-.45,-.91,;.64,.18,;-3.03,-1.6,;-4.56,-1.44,;-5.19,-2.84,;-4.04,-3.87,;-4.04,-5.41,;-2.71,-6.18,;-1.37,-5.41,;.09,-5.89,;1,-4.64,;.09,-3.4,;-1.37,-3.87,;-2.71,-3.1,)|

BDBM198469

OC[C@@H]1CCCN1C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:11.15,wD:8.8,2.1,(4.41,6.18,;3.32,5.09,;3.72,3.61,;5.19,3.13,;5.19,1.59,;3.72,1.11,;2.82,2.36,;1.33,2.76,;.24,1.67,;-1.25,2.07,;-2.34,.98,;-1.94,-.51,;-.45,-.91,;.64,.18,;-3.03,-1.6,;-4.56,-1.44,;-5.19,-2.84,;-4.04,-3.87,;-4.04,-5.41,;-2.71,-6.18,;-1.37,-5.41,;.09,-5.89,;1,-4.64,;.09,-3.4,;-1.37,-3.87,;-2.71,-3.1,)|

BDBM198470

O[C@@H]1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:9.12,wD:6.5,1.0,(5.85,5.04,;4.52,4.27,;4.52,2.73,;3.05,2.26,;2.15,3.5,;.66,3.9,;-.43,2.81,;-1.92,3.21,;-3,2.12,;-2.61,.63,;-1.12,.24,;-.03,1.32,;-3.69,-.46,;-5.23,-.29,;-5.85,-1.7,;-4.71,-2.73,;-4.71,-4.27,;-3.37,-5.04,;-2.04,-4.27,;-.58,-4.75,;.33,-3.5,;-.58,-2.26,;-2.04,-2.73,;-3.37,-1.96,;3.05,4.75,)|

BDBM198471

OCCN(C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)Cc1ccccc1 |r,wU:8.11,wD:5.4,(5.24,5.16,;4.15,4.07,;2.66,4.47,;1.57,3.38,;.08,3.78,;-1.01,2.69,;-2.49,3.09,;-3.58,2,;-3.18,.51,;-1.7,.12,;-.61,1.2,;-4.27,-.58,;-5.8,-.41,;-6.43,-1.82,;-5.29,-2.85,;-5.29,-4.39,;-3.95,-5.16,;-2.62,-4.39,;-1.15,-4.87,;-.25,-3.62,;-1.15,-2.38,;-2.62,-2.85,;-3.95,-2.08,;1.97,1.89,;3.46,1.5,;3.85,.01,;5.34,-.39,;6.43,.7,;6.03,2.19,;4.55,2.58,)|

BDBM198472

FC(F)(Br)CNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:10.13,wD:7.6,(4.94,2.58,;4.55,4.07,;5.63,5.16,;6.03,3.67,;3.06,4.47,;1.97,3.38,;.48,3.78,;-.61,2.69,;-2.1,3.09,;-3.18,2,;-2.79,.51,;-1.3,.12,;-.21,1.2,;-3.87,-.58,;-5.41,-.41,;-6.03,-1.82,;-4.89,-2.85,;-4.89,-4.39,;-3.55,-5.16,;-2.22,-4.39,;-.76,-4.87,;.15,-3.62,;-.76,-2.38,;-2.22,-2.85,;-3.55,-2.08,)|

BDBM198473

COc1ccc(CNC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:12.15,wD:9.8,(8.06,3.97,;6.98,2.88,;5.49,3.28,;4.4,2.19,;2.91,2.58,;2.51,4.07,;1.03,4.47,;-.06,3.38,;-1.55,3.78,;-2.64,2.69,;-4.13,3.09,;-5.22,2,;-4.82,.51,;-3.33,.12,;-2.24,1.2,;-5.91,-.58,;-7.44,-.41,;-8.06,-1.82,;-6.92,-2.85,;-6.92,-4.39,;-5.59,-5.16,;-4.25,-4.39,;-2.79,-4.87,;-1.88,-3.62,;-2.79,-2.38,;-4.25,-2.85,;-5.59,-2.08,;3.6,5.16,;5.09,4.76,)|

BDBM198474

OC1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)CC1 |r,wU:9.12,wD:6.5,(6.23,2.53,;4.74,2.93,;4.35,4.42,;2.86,4.82,;1.77,3.73,;.28,4.13,;-.81,3.04,;-2.29,3.44,;-3.38,2.35,;-2.98,.86,;-1.5,.46,;-.41,1.55,;-4.07,-.23,;-5.61,-.07,;-6.23,-1.48,;-5.09,-2.51,;-5.09,-4.05,;-3.75,-4.82,;-2.42,-4.05,;-.96,-4.52,;-.05,-3.28,;-.96,-2.03,;-2.42,-2.51,;-3.75,-1.74,;2.18,2.24,;3.67,1.84,)|

BDBM198475

OCCNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:8.11,wD:5.4,(5.83,5.16,;4.74,4.07,;3.26,4.47,;2.17,3.38,;.68,3.78,;-.41,2.69,;-1.9,3.09,;-2.98,2,;-2.59,.51,;-1.1,.12,;-.01,1.2,;-3.68,-.58,;-5.21,-.41,;-5.83,-1.82,;-4.69,-2.85,;-4.69,-4.39,;-3.36,-5.16,;-2.02,-4.39,;-.56,-4.87,;.35,-3.62,;-.56,-2.38,;-2.02,-2.85,;-3.36,-2.08,)|

BDBM198476

O=C1COc2cc(NC[C@H]3CC[C@@H](CC3)c3nnn4cnc5[nH]ccc5c34)ccc2N1 |r,wU:12.15,wD:9.8,(7.47,6.81,;6.39,5.71,;6.79,4.21,;5.69,3.11,;4.2,3.51,;3.11,2.42,;1.62,2.82,;.53,1.73,;-.95,2.13,;-2.04,1.04,;-3.53,1.44,;-4.62,.35,;-4.22,-1.13,;-2.73,-1.53,;-1.64,-.44,;-5.31,-2.22,;-6.84,-2.06,;-7.47,-3.47,;-6.32,-4.5,;-6.32,-6.04,;-4.99,-6.81,;-3.66,-6.04,;-2.19,-6.52,;-1.29,-5.27,;-2.19,-4.02,;-3.66,-4.5,;-4.99,-3.73,;1.22,4.31,;2.31,5.4,;3.8,5,;4.89,6.09,)|

BDBM198477

O=C1COc2ccc(NC[C@H]3CC[C@@H](CC3)c3nnn4cnc5[nH]ccc5c34)cc2N1 |r,wU:13.16,wD:10.9,(7.87,4.17,;6.39,4.57,;5.98,6.07,;4.48,6.45,;3.39,5.36,;1.91,5.76,;.82,4.67,;1.22,3.18,;.13,2.09,;-1.36,2.49,;-2.45,1.4,;-3.94,1.8,;-5.03,.71,;-4.63,-.77,;-3.14,-1.17,;-2.05,-.08,;-5.72,-1.86,;-7.25,-1.7,;-7.87,-3.11,;-6.73,-4.14,;-6.73,-5.68,;-5.4,-6.45,;-4.06,-5.68,;-2.6,-6.16,;-1.69,-4.91,;-2.6,-3.66,;-4.06,-4.14,;-5.4,-3.37,;2.7,2.78,;3.79,3.87,;5.28,3.47,)|

BDBM198478

FC1(F)Oc2ccc(NC[C@H]3CC[C@@H](CC3)c3nnn4cnc5[nH]ccc5c34)cc2O1 |r,wU:13.16,wD:10.9,(7.49,4.65,;6.15,5.42,;7.24,6.51,;4.91,6.32,;3.66,5.42,;2.16,5.74,;1.13,4.59,;1.6,3.13,;.51,2.04,;-.97,2.44,;-2.06,1.35,;-3.55,1.75,;-4.64,.66,;-4.24,-.83,;-2.75,-1.23,;-1.66,-.14,;-5.33,-1.92,;-6.86,-1.76,;-7.49,-3.16,;-6.34,-4.2,;-6.34,-5.74,;-5.01,-6.51,;-3.68,-5.74,;-2.21,-6.21,;-1.31,-4.97,;-2.21,-3.72,;-3.68,-4.2,;-5.01,-3.43,;3.11,2.81,;4.14,3.95,;5.68,3.95,)|

BDBM198479

O[C@@H](CNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)c1ccccc1 |r,wU:8.11,wD:5.4,1.0,(5.24,5.16,;4.15,4.07,;2.66,4.47,;1.57,3.38,;.08,3.78,;-1.01,2.69,;-2.49,3.09,;-3.58,2,;-3.18,.51,;-1.7,.12,;-.61,1.2,;-4.27,-.58,;-5.8,-.41,;-6.43,-1.82,;-5.29,-2.85,;-5.29,-4.39,;-3.95,-5.16,;-2.62,-4.39,;-1.15,-4.87,;-.25,-3.62,;-1.15,-2.38,;-2.62,-2.85,;-3.95,-2.08,;4.55,2.58,;3.46,1.5,;3.85,.01,;5.34,-.39,;6.43,.7,;6.03,2.19,)|

BDBM198480

O[C@H](CNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)c1ccccc1 |r,wU:8.11,1.0,wD:5.4,(5.24,5.16,;4.15,4.07,;2.66,4.47,;1.57,3.38,;.08,3.78,;-1.01,2.69,;-2.49,3.09,;-3.58,2,;-3.18,.51,;-1.7,.12,;-.61,1.2,;-4.27,-.58,;-5.8,-.41,;-6.43,-1.82,;-5.29,-2.85,;-5.29,-4.39,;-3.95,-5.16,;-2.62,-4.39,;-1.15,-4.87,;-.25,-3.62,;-1.15,-2.38,;-2.62,-2.85,;-3.95,-2.08,;4.55,2.58,;3.46,1.5,;3.85,.01,;5.34,-.39,;6.43,.7,;6.03,2.19,)|

BDBM198481

OC(=O)C1CN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:10.13,wD:7.6,(6.34,4.01,;5.25,2.92,;5.65,1.44,;3.76,3.32,;2.43,2.55,;1.66,3.89,;.17,4.29,;-.92,3.2,;-2.4,3.6,;-3.49,2.51,;-3.09,1.02,;-1.61,.62,;-.52,1.71,;-4.18,-.07,;-5.71,.09,;-6.34,-1.32,;-5.2,-2.35,;-5.2,-3.89,;-3.86,-4.66,;-2.53,-3.89,;-1.06,-4.36,;-.16,-3.12,;-1.06,-1.87,;-2.53,-2.35,;-3.86,-1.58,;2.99,4.66,)|

BDBM198482

O=C1OCCC1NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:11.15,wD:8.8,(5.7,2.3,;4.93,3.63,;5.41,5.1,;4.16,6,;2.91,5.1,;3.39,3.63,;2.3,2.54,;.81,2.94,;-.28,1.85,;-1.76,2.25,;-2.85,1.16,;-2.45,-.33,;-.97,-.72,;.12,.36,;-3.54,-1.41,;-5.07,-1.25,;-5.7,-2.66,;-4.56,-3.69,;-4.56,-5.23,;-3.22,-6,;-1.89,-5.23,;-.42,-5.71,;.48,-4.46,;-.42,-3.22,;-1.89,-3.69,;-3.22,-2.92,)|

BDBM198483

C(NC1CC1)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:8.12,wD:5.5,(1.22,3.38,;2.71,2.98,;3.8,4.07,;5.29,4.47,;4.2,5.56,;.14,2.29,;-1.35,2.69,;-2.44,1.6,;-2.04,.12,;-.55,-.28,;.53,.81,;-3.13,-.97,;-4.66,-.81,;-5.29,-2.22,;-4.14,-3.25,;-4.14,-4.79,;-2.81,-5.56,;-1.48,-4.79,;-.01,-5.27,;.89,-4.02,;-.01,-2.77,;-1.48,-3.25,;-2.81,-2.48,)|

BDBM198484

N#CC1CN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:9.12,wD:6.5,(6.54,2.53,;5.05,2.92,;3.56,3.32,;2.23,2.55,;1.46,3.89,;-.03,4.29,;-1.12,3.2,;-2.6,3.6,;-3.69,2.51,;-3.29,1.02,;-1.81,.62,;-.72,1.71,;-4.38,-.07,;-5.91,.09,;-6.54,-1.32,;-5.4,-2.35,;-5.4,-3.89,;-4.06,-4.66,;-2.73,-3.89,;-1.26,-4.36,;-.36,-3.12,;-1.26,-1.87,;-2.73,-2.35,;-4.06,-1.58,;2.79,4.66,)|

BDBM198485

N#Cc1ccc(CCNC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:13.16,wD:10.9,(8.01,7.34,;6.92,6.25,;5.83,5.16,;6.23,3.67,;5.14,2.58,;3.66,2.98,;2.57,1.89,;1.08,2.29,;-.01,1.2,;-1.5,1.6,;-2.59,.51,;-4.07,.91,;-5.16,-.18,;-4.76,-1.66,;-3.28,-2.06,;-2.19,-.97,;-5.85,-2.75,;-7.38,-2.59,;-8.01,-4,;-6.87,-5.03,;-6.87,-6.57,;-5.53,-7.34,;-4.2,-6.57,;-2.73,-7.05,;-1.83,-5.8,;-2.73,-4.55,;-4.2,-5.03,;-5.53,-4.26,;3.26,4.47,;4.35,5.56,)|

BDBM198486

C(NC1CCC1)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:9.13,wD:6.6,(1.2,3.36,;2.69,2.96,;3.78,4.05,;5.32,4.05,;5.32,5.59,;3.78,5.59,;.11,2.27,;-1.38,2.67,;-2.47,1.58,;-2.07,.09,;-.58,-.31,;.51,.78,;-3.16,-1,;-4.69,-.84,;-5.32,-2.25,;-4.17,-3.28,;-4.17,-4.82,;-2.84,-5.59,;-1.5,-4.82,;-.04,-5.29,;.87,-4.05,;-.04,-2.8,;-1.5,-3.28,;-2.84,-2.51,)|

BDBM198487

C(NC1CCCC1)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:10.14,wD:7.7,(.96,2.94,;2.45,2.54,;3.54,3.63,;5.08,3.63,;5.55,5.1,;4.31,6,;3.06,5.1,;-.13,1.85,;-1.62,2.25,;-2.7,1.16,;-2.31,-.33,;-.82,-.72,;.27,.36,;-3.4,-1.41,;-4.93,-1.25,;-5.55,-2.66,;-4.41,-3.69,;-4.41,-5.23,;-3.07,-6,;-1.74,-5.23,;-.28,-5.71,;.63,-4.46,;-.28,-3.22,;-1.74,-3.69,;-3.07,-2.92,)|

BDBM198488

C(NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)C1CC1 |r,wU:6.9,wD:3.2,(3.06,4.82,;1.97,3.73,;.48,4.13,;-.61,3.04,;-2.1,3.44,;-3.18,2.35,;-2.79,.86,;-1.3,.46,;-.21,1.55,;-3.87,-.23,;-5.41,-.07,;-6.03,-1.48,;-4.89,-2.51,;-4.89,-4.05,;-3.55,-4.82,;-2.22,-4.05,;-.76,-4.52,;.15,-3.28,;-.76,-2.03,;-2.22,-2.51,;-3.55,-1.74,;4.55,4.42,;5.63,3.33,;6.03,4.82,)|

BDBM198489

C([C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)N1CCC1 |r,wU:4.7,wD:1.0,(1.46,4.29,;.37,3.2,;-1.12,3.6,;-2.2,2.51,;-1.81,1.02,;-.32,.62,;.77,1.71,;-2.89,-.07,;-4.43,.09,;-5.05,-1.32,;-3.91,-2.35,;-3.91,-3.89,;-2.57,-4.66,;-1.24,-3.89,;.22,-4.36,;1.13,-3.12,;.22,-1.87,;-1.24,-2.35,;-2.57,-1.58,;2.95,3.89,;3.72,2.55,;5.05,3.32,;4.28,4.66,)|

BDBM198490

C([C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)N1CCCC1 |r,wU:4.7,wD:1.0,(1.33,4.05,;.24,2.96,;-1.25,3.36,;-2.34,2.27,;-1.94,.78,;-.45,.38,;.64,1.47,;-3.03,-.31,;-4.56,-.15,;-5.19,-1.55,;-4.04,-2.58,;-4.04,-4.12,;-2.71,-4.89,;-1.37,-4.12,;.09,-4.6,;1,-3.35,;.09,-2.11,;-1.37,-2.58,;-2.71,-1.81,;2.82,3.65,;3.72,2.4,;5.19,2.88,;5.19,4.42,;3.72,4.89,)|

BDBM198491

O=C1NOC[C@H]1NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:11.15,wD:8.8,5.6,(5.7,2.3,;4.93,3.63,;5.41,5.1,;4.16,6,;2.91,5.1,;3.39,3.63,;2.3,2.54,;.81,2.94,;-.28,1.85,;-1.76,2.25,;-2.85,1.16,;-2.45,-.33,;-.97,-.72,;.12,.36,;-3.54,-1.41,;-5.07,-1.25,;-5.7,-2.66,;-4.56,-3.69,;-4.56,-5.23,;-3.22,-6,;-1.89,-5.23,;-.42,-5.71,;.48,-4.46,;-.42,-3.22,;-1.89,-3.69,;-3.22,-2.92,)|

BDBM198492

C(NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)[C@H]1CCCO1 |r,wU:6.9,wD:3.2,21.24,(2.62,4.39,;1.53,3.3,;.04,3.7,;-1.05,2.61,;-2.54,3.01,;-3.63,1.92,;-3.23,.44,;-1.74,.04,;-.65,1.13,;-4.32,-.65,;-5.85,-.49,;-6.47,-1.9,;-5.33,-2.93,;-5.33,-4.47,;-4,-5.24,;-2.66,-4.47,;-1.2,-4.95,;-.29,-3.7,;-1.2,-2.45,;-2.66,-2.93,;-4,-2.16,;4.1,3.99,;5.01,2.75,;6.47,3.22,;6.47,4.76,;5.01,5.24,)|

BDBM198493

CC1(C)CC1NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:10.14,wD:7.7,(5.88,4.05,;4.55,4.82,;5.88,5.59,;3.21,5.59,;3.21,4.05,;2.12,2.96,;.63,3.36,;-.45,2.27,;-1.94,2.67,;-3.03,1.58,;-2.63,.09,;-1.14,-.31,;-.06,.78,;-3.72,-1,;-5.25,-.84,;-5.88,-2.25,;-4.73,-3.28,;-4.73,-4.82,;-3.4,-5.59,;-2.07,-4.82,;-.6,-5.29,;.3,-4.05,;-.6,-2.8,;-2.07,-3.28,;-3.4,-2.51,)|

BDBM198494

CC1CC1NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:9.13,wD:6.6,(6.03,4.07,;4.55,4.47,;3.46,5.56,;3.06,4.07,;1.97,2.98,;.48,3.38,;-.61,2.29,;-2.1,2.69,;-3.18,1.6,;-2.79,.12,;-1.3,-.28,;-.21,.81,;-3.87,-.97,;-5.41,-.81,;-6.03,-2.22,;-4.89,-3.25,;-4.89,-4.79,;-3.55,-5.56,;-2.22,-4.79,;-.76,-5.27,;.15,-4.02,;-.76,-2.77,;-2.22,-3.25,;-3.55,-2.48,)|

BDBM198495

FC(F)(F)C1(CC1)NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:12.16,wD:9.9,(4.94,2.19,;4.55,3.67,;5.63,4.76,;6.03,3.28,;3.06,4.07,;3.46,5.56,;1.97,5.16,;1.97,2.98,;.48,3.38,;-.61,2.29,;-2.1,2.69,;-3.18,1.6,;-2.79,.12,;-1.3,-.28,;-.21,.81,;-3.87,-.97,;-5.41,-.81,;-6.03,-2.22,;-4.89,-3.25,;-4.89,-4.79,;-3.55,-5.56,;-2.22,-4.79,;-.76,-5.27,;.15,-4.02,;-.76,-2.77,;-2.22,-3.25,;-3.55,-2.48,)|

BDBM198496

COCC1(CC1)NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:11.15,wD:8.8,(6.58,4.36,;5.09,4.76,;4,3.67,;2.51,4.07,;2.91,5.56,;1.42,5.16,;1.42,2.98,;-.06,3.38,;-1.15,2.29,;-2.64,2.69,;-3.73,1.6,;-3.33,.12,;-1.84,-.28,;-.75,.81,;-4.42,-.97,;-5.95,-.81,;-6.58,-2.22,;-5.43,-3.25,;-5.43,-4.79,;-4.1,-5.56,;-2.77,-4.79,;-1.3,-5.27,;-.4,-4.02,;-1.3,-2.77,;-2.77,-3.25,;-4.1,-2.48,)|

BDBM198497

C(NC1COC1)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:9.13,wD:6.6,(1.2,3.36,;2.69,2.96,;3.78,4.05,;5.32,4.05,;5.32,5.59,;3.78,5.59,;.11,2.27,;-1.38,2.67,;-2.47,1.58,;-2.07,.09,;-.58,-.31,;.51,.78,;-3.16,-1,;-4.69,-.84,;-5.32,-2.25,;-4.17,-3.28,;-4.17,-4.82,;-2.84,-5.59,;-1.5,-4.82,;-.04,-5.29,;.87,-4.05,;-.04,-2.8,;-1.5,-3.28,;-2.84,-2.51,)|

BDBM198498

CC1(CC1)NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:9.13,wD:6.6,(5.29,3.67,;3.8,4.07,;4.2,5.56,;2.71,5.16,;2.71,2.98,;1.22,3.38,;.14,2.29,;-1.35,2.69,;-2.44,1.6,;-2.04,.12,;-.55,-.28,;.53,.81,;-3.13,-.97,;-4.66,-.81,;-5.29,-2.22,;-4.14,-3.25,;-4.14,-4.79,;-2.81,-5.56,;-1.48,-4.79,;-.01,-5.27,;.89,-4.02,;-.01,-2.77,;-1.48,-3.25,;-2.81,-2.48,)|

BDBM198499

CN(C)C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:7.10,wD:4.3,(4.55,4.82,;3.46,3.73,;3.85,2.24,;1.97,4.13,;.88,3.04,;-.61,3.44,;-1.7,2.35,;-1.3,.86,;.19,.46,;1.28,1.55,;-2.39,-.23,;-3.92,-.07,;-4.55,-1.48,;-3.4,-2.51,;-3.4,-4.05,;-2.07,-4.82,;-.73,-4.05,;.73,-4.52,;1.64,-3.28,;.73,-2.03,;-.73,-2.51,;-2.07,-1.74,)|

BDBM198500

CN(CCO)C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:9.12,wD:6.5,(2.57,1.89,;2.17,3.38,;3.26,4.47,;4.74,4.07,;5.83,5.16,;.68,3.78,;-.41,2.69,;-1.9,3.09,;-2.98,2,;-2.59,.51,;-1.1,.12,;-.01,1.2,;-3.68,-.58,;-5.21,-.41,;-5.83,-1.82,;-4.69,-2.85,;-4.69,-4.39,;-3.36,-5.16,;-2.02,-4.39,;-.56,-4.87,;.35,-3.62,;-.56,-2.38,;-2.02,-2.85,;-3.36,-2.08,)|

BDBM198501

OCCN(CCO)C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:11.14,wD:8.7,(4.45,.01,;4.05,1.5,;2.57,1.89,;2.17,3.38,;3.26,4.47,;4.74,4.07,;5.83,5.16,;.68,3.78,;-.41,2.69,;-1.9,3.09,;-2.98,2,;-2.59,.51,;-1.1,.12,;-.01,1.2,;-3.68,-.58,;-5.21,-.41,;-5.83,-1.82,;-4.69,-2.85,;-4.69,-4.39,;-3.36,-5.16,;-2.02,-4.39,;-.56,-4.87,;.35,-3.62,;-.56,-2.38,;-2.02,-2.85,;-3.36,-2.08,)|

BDBM198502

CC(C)(C)OC(=O)N[C@@H]1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:16.19,wD:13.12,8.7,(8.52,5.04,;7.19,4.27,;7.19,2.73,;8.52,3.5,;5.85,5.04,;4.52,4.27,;4.52,2.73,;3.19,5.04,;1.85,4.27,;1.85,2.73,;.39,2.26,;-.52,3.5,;-2.01,3.9,;-3.09,2.81,;-4.58,3.21,;-5.67,2.12,;-5.27,.63,;-3.79,.24,;-2.7,1.32,;-6.36,-.46,;-7.89,-.29,;-8.52,-1.7,;-7.38,-2.73,;-7.38,-4.27,;-6.04,-5.04,;-4.71,-4.27,;-3.24,-4.75,;-2.34,-3.5,;-3.24,-2.26,;-4.71,-2.73,;-6.04,-1.96,;.39,4.75,)|

BDBM198503

N#CCCN(C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)c1ccccc1 |r,wU:9.12,wD:6.5,(6.38,5.71,;5.29,4.62,;4.2,3.53,;2.71,3.93,;1.62,2.84,;.14,3.24,;-.95,2.15,;-2.44,2.55,;-3.53,1.46,;-3.13,-.03,;-1.64,-.43,;-.55,.66,;-4.22,-1.12,;-5.75,-.96,;-6.38,-2.37,;-5.23,-3.4,;-5.23,-4.94,;-3.9,-5.71,;-2.57,-4.94,;-1.1,-5.41,;-.2,-4.17,;-1.1,-2.92,;-2.57,-3.4,;-3.9,-2.63,;2.02,1.35,;.93,.26,;1.33,-1.23,;2.82,-1.62,;3.91,-.54,;3.51,.95,)|

BDBM198504

N#C[C@@H]1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:10.13,wD:7.6,2.1,(6.52,5.43,;5.19,4.66,;3.85,3.89,;3.85,2.35,;2.39,1.87,;1.48,3.12,;-.01,3.52,;-1.09,2.43,;-2.58,2.83,;-3.67,1.74,;-3.27,.25,;-1.78,-.15,;-.7,.94,;-4.36,-.84,;-5.89,-.68,;-6.52,-2.09,;-5.37,-3.12,;-5.37,-4.66,;-4.04,-5.43,;-2.71,-4.66,;-1.24,-5.13,;-.34,-3.89,;-1.24,-2.64,;-2.71,-3.12,;-4.04,-2.35,;2.39,4.36,)|

BDBM198505

CN(CCC#N)C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:10.13,wD:7.6,(2.02,1.35,;1.62,2.84,;2.71,3.93,;4.2,3.53,;5.29,4.62,;6.38,5.71,;.14,3.24,;-.95,2.15,;-2.44,2.55,;-3.53,1.46,;-3.13,-.03,;-1.64,-.43,;-.55,.66,;-4.22,-1.12,;-5.75,-.96,;-6.38,-2.37,;-5.23,-3.4,;-5.23,-4.94,;-3.9,-5.71,;-2.57,-4.94,;-1.1,-5.41,;-.2,-4.17,;-1.1,-2.92,;-2.57,-3.4,;-3.9,-2.63,)|

BDBM198506

OC12CC3CC(C1)C(NC[C@H]1CC[C@@H](CC1)c1nnn4cnc5[nH]ccc5c14)C(C3)C2 |r,wU:13.17,wD:10.10,TLB:8:7:4:1.2.6,0:1:4:7.28.29,THB:8:7:1.30.6:4.3.29,2:1:7:4.3.29,2:3:7:1.30.6,30:1:4:7.28.29,30:28:4:1.2.6,(7.04,3.9,;5.55,4.3,;5.55,5.84,;4.22,6.61,;2.89,5.84,;2.89,4.3,;4.22,3.53,;2.05,3.02,;.96,1.93,;-.52,2.33,;-1.61,1.24,;-3.1,1.64,;-4.19,.55,;-3.79,-.93,;-2.3,-1.33,;-1.21,-.24,;-4.88,-2.02,;-6.41,-1.86,;-7.04,-3.27,;-5.89,-4.3,;-5.89,-5.84,;-4.56,-6.61,;-3.22,-5.84,;-1.76,-6.32,;-.85,-5.07,;-1.76,-3.82,;-3.22,-4.3,;-4.56,-3.53,;3.45,3.04,;3.47,5.44,;4.65,2.38,)|

BDBM198507

OC12CC3CC(C1)C(NC[C@H]1CC[C@@H](CC1)c1nnn4cnc5[nH]ccc5c14)C(C3)C2 |r,wU:13.17,wD:10.10,TLB:8:7:3.4.29:30.1.6,4:3:30:7.5.6,4:5:30:3.2.29,THB:8:7:30:3.2.29,2:3:7:30.1.6,2:1:7:3.4.29,(4.96,7.38,;4.96,5.84,;6.29,5.07,;6.29,3.53,;5.4,1.61,;4.19,2.27,;4.21,4.67,;2.8,2.25,;1.71,1.16,;.22,1.56,;-.87,.47,;-2.36,.87,;-3.44,-.22,;-3.05,-1.7,;-1.56,-2.1,;-.47,-1.01,;-4.13,-2.79,;-5.67,-2.63,;-6.29,-4.04,;-5.15,-5.07,;-5.15,-6.61,;-3.81,-7.38,;-2.48,-6.61,;-1.02,-7.09,;-.11,-5.84,;-1.02,-4.59,;-2.48,-5.07,;-3.81,-4.3,;3.63,3.53,;4.96,2.76,;3.63,5.07,)|

BDBM198508

O[C@H]1CC[C@@H](CC1)NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:12.16,4.7,wD:9.9,1.0,(6.18,6.45,;5.09,5.36,;3.6,5.76,;2.51,4.67,;2.91,3.18,;4.4,2.78,;5.49,3.87,;1.82,2.09,;.34,2.49,;-.75,1.4,;-2.24,1.8,;-3.33,.71,;-2.93,-.77,;-1.44,-1.17,;-.36,-.08,;-4.02,-1.86,;-5.55,-1.7,;-6.18,-3.11,;-5.03,-4.14,;-5.03,-5.68,;-3.7,-6.45,;-2.37,-5.68,;-.9,-6.16,;0,-4.91,;-.9,-3.66,;-2.37,-4.14,;-3.7,-3.37,)|

BDBM198509

OCCN(C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)C1CCCCC1 |r,wU:8.11,wD:5.4,(5.83,5.16,;4.74,4.07,;3.26,4.47,;2.17,3.38,;.68,3.78,;-.41,2.69,;-1.9,3.09,;-2.98,2,;-2.59,.51,;-1.1,.12,;-.01,1.2,;-3.68,-.58,;-5.21,-.41,;-5.83,-1.82,;-4.69,-2.85,;-4.69,-4.39,;-3.36,-5.16,;-2.02,-4.39,;-.56,-4.87,;.35,-3.62,;-.56,-2.38,;-2.02,-2.85,;-3.36,-2.08,;2.57,1.89,;1.48,.81,;1.88,-.68,;3.36,-1.08,;4.45,.01,;4.05,1.5,)|

BDBM198510

CC(C)(C)OC(=O)N[C@H]1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:16.19,8.7,wD:13.12,(8.52,5.04,;7.19,4.27,;7.19,2.73,;8.52,3.5,;5.85,5.04,;4.52,4.27,;4.52,2.73,;3.19,5.04,;1.85,4.27,;1.85,2.73,;.39,2.26,;-.52,3.5,;-2.01,3.9,;-3.09,2.81,;-4.58,3.21,;-5.67,2.12,;-5.27,.63,;-3.79,.24,;-2.7,1.32,;-6.36,-.46,;-7.89,-.29,;-8.52,-1.7,;-7.38,-2.73,;-7.38,-4.27,;-6.04,-5.04,;-4.71,-4.27,;-3.24,-4.75,;-2.34,-3.5,;-3.24,-2.26,;-4.71,-2.73,;-6.04,-1.96,;.39,4.75,)|

BDBM198511

Clc1ccc(cc1)C1(COC1)NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:16.21,wD:13.14,(7.52,2.17,;6.03,2.57,;4.94,1.48,;3.46,1.88,;3.06,3.37,;4.15,4.45,;5.63,4.06,;1.57,3.76,;2.34,5.1,;1.01,5.87,;.24,4.53,;.48,2.68,;-1.01,3.07,;-2.1,1.99,;-3.58,2.38,;-4.67,1.29,;-4.27,-.19,;-2.79,-.59,;-1.7,.5,;-5.36,-1.28,;-6.89,-1.12,;-7.52,-2.53,;-6.38,-3.56,;-6.38,-5.1,;-5.04,-5.87,;-3.71,-5.1,;-2.24,-5.57,;-1.34,-4.33,;-2.24,-3.08,;-3.71,-3.56,;-5.04,-2.79,)|

BDBM198512

OC1(CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)CC1)c1ccc(Cl)c(c1)C(F)(F)F |r,wU:9.12,wD:6.5,(3.5,4.02,;2.41,2.93,;1.32,1.84,;-.17,2.24,;-.57,3.73,;-2.05,4.13,;-3.14,3.04,;-4.63,3.44,;-5.72,2.35,;-5.32,.86,;-3.83,.46,;-2.74,1.55,;-6.41,-.23,;-7.94,-.07,;-8.57,-1.48,;-7.42,-2.51,;-7.42,-4.05,;-6.09,-4.82,;-4.76,-4.05,;-3.29,-4.52,;-2.39,-3.28,;-3.29,-2.03,;-4.76,-2.51,;-6.09,-1.74,;.52,4.82,;2.01,4.42,;3.18,1.6,;2.41,.26,;3.18,-1.07,;4.72,-1.07,;5.49,-2.4,;5.49,.26,;4.72,1.6,;7.03,.26,;7.8,-1.07,;7.8,1.6,;8.57,.26,)|

BDBM198513

N#CC1(CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)CC1)c1ccccc1 |r,wU:10.13,wD:7.6,(6.13,4.96,;5.04,3.87,;3.95,2.78,;2.86,1.7,;1.37,2.09,;.97,3.58,;-.51,3.98,;-1.6,2.89,;-3.09,3.29,;-4.18,2.2,;-3.78,.71,;-2.29,.31,;-1.2,1.4,;-4.87,-.38,;-6.4,-.21,;-7.03,-1.62,;-5.88,-2.65,;-5.88,-4.19,;-4.55,-4.96,;-3.22,-4.19,;-1.75,-4.67,;-.85,-3.42,;-1.75,-2.18,;-3.22,-2.65,;-4.55,-1.88,;2.06,4.67,;3.55,4.27,;4.72,1.45,;3.95,.12,;4.72,-1.22,;6.26,-1.22,;7.03,.12,;6.26,1.45,)|

BDBM198514

CC(C)(O)C1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)CC1 |r,wU:12.15,wD:9.8,(6.58,3.62,;5.49,2.53,;5.89,1.04,;6.98,2.13,;4,2.93,;2.91,1.84,;1.42,2.24,;1.03,3.73,;-.46,4.13,;-1.55,3.04,;-3.04,3.44,;-4.13,2.35,;-3.73,.86,;-2.24,.46,;-1.15,1.55,;-4.82,-.23,;-6.35,-.07,;-6.98,-1.48,;-5.83,-2.51,;-5.83,-4.05,;-4.5,-4.82,;-3.16,-4.05,;-1.7,-4.52,;-.79,-3.28,;-1.7,-2.03,;-3.16,-2.51,;-4.5,-1.74,;2.11,4.82,;3.6,4.42,)|

BDBM198515

O[C@H]1CCCC[C@H]1CNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:13.17,wD:10.10,6.7,1.0,(3.11,1.5,;4.2,2.58,;5.69,2.19,;6.78,3.28,;6.38,4.76,;4.89,5.16,;3.8,4.07,;2.31,4.47,;1.22,3.38,;-.26,3.78,;-1.35,2.69,;-2.84,3.09,;-3.93,2,;-3.53,.51,;-2.04,.12,;-.95,1.2,;-4.62,-.58,;-6.15,-.41,;-6.78,-1.82,;-5.63,-2.85,;-5.63,-4.39,;-4.3,-5.16,;-2.96,-4.39,;-1.5,-4.87,;-.59,-3.62,;-1.5,-2.38,;-2.96,-2.85,;-4.3,-2.08,)|

BDBM198516

OC1(CNC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)CCCCC1 |r,wU:8.11,wD:5.4,(5.43,5.16,;4.35,4.07,;2.86,4.47,;1.77,3.38,;.28,3.78,;-.81,2.69,;-2.29,3.09,;-3.38,2,;-2.98,.51,;-1.5,.12,;-.41,1.2,;-4.07,-.58,;-5.61,-.41,;-6.23,-1.82,;-5.09,-2.85,;-5.09,-4.39,;-3.75,-5.16,;-2.42,-4.39,;-.96,-4.87,;-.05,-3.62,;-.96,-2.38,;-2.42,-2.85,;-3.75,-2.08,;3.26,2.98,;3.66,1.5,;5.14,1.1,;6.23,2.19,;5.83,3.67,)|

BDBM198517

N#CCCN1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)CC1 |r,wU:12.15,wD:9.8,(7.92,.25,;6.43,.65,;4.94,1.04,;4.55,2.53,;3.06,2.93,;1.97,1.84,;.48,2.24,;.08,3.73,;-1.41,4.13,;-2.49,3.04,;-3.98,3.44,;-5.07,2.35,;-4.67,.86,;-3.18,.46,;-2.1,1.55,;-5.76,-.23,;-7.29,-.07,;-7.92,-1.48,;-6.77,-2.51,;-6.77,-4.05,;-5.44,-4.82,;-4.11,-4.05,;-2.64,-4.52,;-1.74,-3.28,;-2.64,-2.03,;-4.11,-2.51,;-5.44,-1.74,;1.17,4.82,;2.66,4.42,)|

BDBM198518

OCCN1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)CC1 |r,wU:11.14,wD:8.7,(7.17,.65,;5.69,1.04,;5.29,2.53,;3.8,2.93,;2.71,1.84,;1.22,2.24,;.83,3.73,;-.66,4.13,;-1.75,3.04,;-3.24,3.44,;-4.33,2.35,;-3.93,.86,;-2.44,.46,;-1.35,1.55,;-5.02,-.23,;-6.55,-.07,;-7.17,-1.48,;-6.03,-2.51,;-6.03,-4.05,;-4.7,-4.82,;-3.36,-4.05,;-1.9,-4.52,;-.99,-3.28,;-1.9,-2.03,;-3.36,-2.51,;-4.7,-1.74,;1.92,4.82,;3.4,4.42,)|

BDBM198519

C(NC12CC(C1)C2)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:10.15,wD:7.8,(1.2,3.36,;2.69,2.96,;3.78,4.05,;5.32,4.05,;5.32,5.59,;3.78,5.59,;4.2,5.16,;.11,2.27,;-1.38,2.67,;-2.47,1.58,;-2.07,.09,;-.58,-.31,;.51,.78,;-3.16,-1,;-4.69,-.84,;-5.32,-2.25,;-4.17,-3.28,;-4.17,-4.82,;-2.84,-5.59,;-1.5,-4.82,;-.04,-5.29,;.87,-4.05,;-.04,-2.8,;-1.5,-3.28,;-2.84,-2.51,)|

BDBM198520

FC(F)(F)C(NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)C(F)(F)F |r,wU:10.13,wD:7.6,(4.94,1.44,;4.55,2.93,;5.63,4.02,;6.03,2.53,;3.06,3.33,;1.97,2.24,;.48,2.64,;-.61,1.55,;-2.1,1.95,;-3.18,.86,;-2.79,-.63,;-1.3,-1.03,;-.21,.06,;-3.87,-1.72,;-5.41,-1.56,;-6.03,-2.96,;-4.89,-3.99,;-4.89,-5.53,;-3.55,-6.3,;-2.22,-5.53,;-.76,-6.01,;.15,-4.76,;-.76,-3.52,;-2.22,-3.99,;-3.55,-3.22,;2.66,4.82,;3.75,5.91,;1.17,5.21,;2.26,6.3,)|

BDBM198521

CC(=O)N[C@@H]1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:12.15,wD:9.8,4.3,(7.19,5.04,;5.85,4.27,;5.85,2.73,;4.52,5.04,;3.19,4.27,;3.19,2.73,;1.72,2.26,;.82,3.5,;-.67,3.9,;-1.76,2.81,;-3.25,3.21,;-4.34,2.12,;-3.94,.63,;-2.45,.24,;-1.36,1.32,;-5.03,-.46,;-6.56,-.29,;-7.19,-1.7,;-6.04,-2.73,;-6.04,-4.27,;-4.71,-5.04,;-3.37,-4.27,;-1.91,-4.75,;-1,-3.5,;-1.91,-2.26,;-3.37,-2.73,;-4.71,-1.96,;1.72,4.75,)|

BDBM198522

CC(=O)N[C@H]1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:12.15,4.3,wD:9.8,(7.19,5.04,;5.85,4.27,;5.85,2.73,;4.52,5.04,;3.19,4.27,;3.19,2.73,;1.72,2.26,;.82,3.5,;-.67,3.9,;-1.76,2.81,;-3.25,3.21,;-4.34,2.12,;-3.94,.63,;-2.45,.24,;-1.36,1.32,;-5.03,-.46,;-6.56,-.29,;-7.19,-1.7,;-6.04,-2.73,;-6.04,-4.27,;-4.71,-5.04,;-3.37,-4.27,;-1.91,-4.75,;-1,-3.5,;-1.91,-2.26,;-3.37,-2.73,;-4.71,-1.96,;1.72,4.75,)|

BDBM198523

FC(F)(F)C(=O)N[C@@H]1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:15.18,wD:12.11,7.6,(7.85,3.5,;6.52,4.27,;6.52,5.81,;7.85,5.04,;5.19,3.5,;5.19,1.96,;3.85,4.27,;2.52,3.5,;2.52,1.96,;1.05,1.49,;.15,2.73,;-1.34,3.13,;-2.43,2.04,;-3.92,2.44,;-5,1.35,;-4.61,-.14,;-3.12,-.53,;-2.03,.55,;-5.7,-1.23,;-7.23,-1.06,;-7.85,-2.47,;-6.71,-3.5,;-6.71,-5.04,;-5.37,-5.81,;-4.04,-5.04,;-2.58,-5.52,;-1.67,-4.27,;-2.58,-3.03,;-4.04,-3.5,;-5.37,-2.73,;1.05,3.98,)|

BDBM198524

FC(F)(F)C(=O)N[C@H]1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:15.18,7.6,wD:12.11,(7.85,3.5,;6.52,4.27,;6.52,5.81,;7.85,5.04,;5.19,3.5,;5.19,1.96,;3.85,4.27,;2.52,3.5,;2.52,1.96,;1.05,1.49,;.15,2.73,;-1.34,3.13,;-2.43,2.04,;-3.92,2.44,;-5,1.35,;-4.61,-.14,;-3.12,-.53,;-2.03,.55,;-5.7,-1.23,;-7.23,-1.06,;-7.85,-2.47,;-6.71,-3.5,;-6.71,-5.04,;-5.37,-5.81,;-4.04,-5.04,;-2.58,-5.52,;-1.67,-4.27,;-2.58,-3.03,;-4.04,-3.5,;-5.37,-2.73,;1.05,3.98,)|

BDBM198525

Fc1ccc(cc1)C1(COC1)NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:16.21,wD:13.14,(7.52,2.17,;6.03,2.57,;4.94,1.48,;3.46,1.88,;3.06,3.37,;4.15,4.45,;5.63,4.06,;1.57,3.76,;2.34,5.1,;1.01,5.87,;.24,4.53,;.48,2.68,;-1.01,3.07,;-2.1,1.99,;-3.58,2.38,;-4.67,1.29,;-4.27,-.19,;-2.79,-.59,;-1.7,.5,;-5.36,-1.28,;-6.89,-1.12,;-7.52,-2.53,;-6.38,-3.56,;-6.38,-5.1,;-5.04,-5.87,;-3.71,-5.1,;-2.24,-5.57,;-1.34,-4.33,;-2.24,-3.08,;-3.71,-3.56,;-5.04,-2.79,)|

BDBM198526

Fc1ccc(cc1)C1(CC1)NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:15.20,wD:12.13,(7.52,2.48,;6.03,2.88,;4.94,1.79,;3.46,2.19,;3.06,3.67,;4.15,4.76,;5.63,4.36,;1.57,4.07,;1.97,5.56,;.48,5.16,;.48,2.98,;-1.01,3.38,;-2.1,2.29,;-3.58,2.69,;-4.67,1.6,;-4.27,.12,;-2.79,-.28,;-1.7,.81,;-5.36,-.97,;-6.89,-.81,;-7.52,-2.22,;-6.38,-3.25,;-6.38,-4.79,;-5.04,-5.56,;-3.71,-4.79,;-2.24,-5.27,;-1.34,-4.02,;-2.24,-2.77,;-3.71,-3.25,;-5.04,-2.48,)|

BDBM198527

Fc1ccc(cc1)C1(CCC1)NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:16.21,wD:13.14,(7.52,2.17,;6.03,2.57,;4.94,1.48,;3.46,1.88,;3.06,3.37,;4.15,4.45,;5.63,4.06,;1.57,3.76,;2.34,5.1,;1.01,5.87,;.24,4.53,;.48,2.68,;-1.01,3.07,;-2.1,1.99,;-3.58,2.38,;-4.67,1.29,;-4.27,-.19,;-2.79,-.59,;-1.7,.5,;-5.36,-1.28,;-6.89,-1.12,;-7.52,-2.53,;-6.38,-3.56,;-6.38,-5.1,;-5.04,-5.87,;-3.71,-5.1,;-2.24,-5.57,;-1.34,-4.33,;-2.24,-3.08,;-3.71,-3.56,;-5.04,-2.79,)|

BDBM198528

COCCN(C)C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:10.13,wD:7.6,(6.58,4.76,;5.09,5.16,;4,4.07,;2.51,4.47,;1.42,3.38,;1.82,1.89,;-.06,3.78,;-1.15,2.69,;-2.64,3.09,;-3.73,2,;-3.33,.51,;-1.84,.12,;-.75,1.2,;-4.42,-.58,;-5.95,-.41,;-6.58,-1.82,;-5.43,-2.85,;-5.43,-4.39,;-4.1,-5.16,;-2.77,-4.39,;-1.3,-4.87,;-.4,-3.62,;-1.3,-2.38,;-2.77,-2.85,;-4.1,-2.08,)|

BDBM198529

COCCN(CCOC)C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:13.16,wD:10.9,(6.58,4.76,;5.09,5.16,;4,4.07,;2.51,4.47,;1.42,3.38,;1.82,1.89,;3.31,1.5,;3.71,.01,;5.2,-.39,;-.06,3.78,;-1.15,2.69,;-2.64,3.09,;-3.73,2,;-3.33,.51,;-1.84,.12,;-.75,1.2,;-4.42,-.58,;-5.95,-.41,;-6.58,-1.82,;-5.43,-2.85,;-5.43,-4.39,;-4.1,-5.16,;-2.77,-4.39,;-1.3,-4.87,;-.4,-3.62,;-1.3,-2.38,;-2.77,-2.85,;-4.1,-2.08,)|

BDBM198530

OCC1(CC1)NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:10.14,wD:7.7,(5.83,4.76,;4.74,3.67,;3.26,4.07,;3.66,5.56,;2.17,5.16,;2.17,2.98,;.68,3.38,;-.41,2.29,;-1.9,2.69,;-2.98,1.6,;-2.59,.12,;-1.1,-.28,;-.01,.81,;-3.68,-.97,;-5.21,-.81,;-5.83,-2.22,;-4.69,-3.25,;-4.69,-4.79,;-3.36,-5.56,;-2.02,-4.79,;-.56,-5.27,;.35,-4.02,;-.56,-2.77,;-2.02,-3.25,;-3.36,-2.48,)|

BDBM198531

FC1(F)CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:10.13,wD:7.6,(5.85,5.04,;4.52,4.27,;5.85,3.5,;4.52,2.73,;3.05,2.26,;2.15,3.5,;.66,3.9,;-.43,2.81,;-1.92,3.21,;-3,2.12,;-2.61,.63,;-1.12,.24,;-.03,1.32,;-3.69,-.46,;-5.23,-.29,;-5.85,-1.7,;-4.71,-2.73,;-4.71,-4.27,;-3.37,-5.04,;-2.04,-4.27,;-.58,-4.75,;.33,-3.5,;-.58,-2.26,;-2.04,-2.73,;-3.37,-1.96,;3.05,4.75,)|

BDBM198532

CNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:6.9,wD:3.2,(4.55,4.82,;3.46,3.73,;1.97,4.13,;.88,3.04,;-.61,3.44,;-1.7,2.35,;-1.3,.86,;.19,.46,;1.28,1.55,;-2.39,-.23,;-3.92,-.07,;-4.55,-1.48,;-3.4,-2.51,;-3.4,-4.05,;-2.07,-4.82,;-.73,-4.05,;.73,-4.52,;1.64,-3.28,;.73,-2.03,;-.73,-2.51,;-2.07,-1.74,)|

BDBM198533

CCNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:7.10,wD:4.3,(5.29,4.42,;3.8,4.82,;2.71,3.73,;1.22,4.13,;.14,3.04,;-1.35,3.44,;-2.44,2.35,;-2.04,.86,;-.55,.46,;.53,1.55,;-3.13,-.23,;-4.66,-.07,;-5.29,-1.48,;-4.14,-2.51,;-4.14,-4.05,;-2.81,-4.82,;-1.48,-4.05,;-.01,-4.52,;.89,-3.28,;-.01,-2.03,;-1.48,-2.51,;-2.81,-1.74,)|

BDBM198534

CC(C)NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:8.11,wD:5.4,(5.29,3.67,;3.8,4.07,;3.4,5.56,;2.71,2.98,;1.22,3.38,;.14,2.29,;-1.35,2.69,;-2.44,1.6,;-2.04,.12,;-.55,-.28,;.53,.81,;-3.13,-.97,;-4.66,-.81,;-5.29,-2.22,;-4.14,-3.25,;-4.14,-4.79,;-2.81,-5.56,;-1.48,-4.79,;-.01,-5.27,;.89,-4.02,;-.01,-2.77,;-1.48,-3.25,;-2.81,-2.48,)|

BDBM198535

CC(C)(C)NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:9.12,wD:6.5,(5.29,3.67,;3.8,4.07,;3.4,5.56,;4.89,5.16,;2.71,2.98,;1.22,3.38,;.14,2.29,;-1.35,2.69,;-2.44,1.6,;-2.04,.12,;-.55,-.28,;.53,.81,;-3.13,-.97,;-4.66,-.81,;-5.29,-2.22,;-4.14,-3.25,;-4.14,-4.79,;-2.81,-5.56,;-1.48,-4.79,;-.01,-5.27,;.89,-4.02,;-.01,-2.77,;-1.48,-3.25,;-2.81,-2.48,)|

BDBM198536

C#CCNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:8.11,wD:5.4,(6.03,4.02,;4.55,4.42,;3.06,4.82,;1.97,3.73,;.48,4.13,;-.61,3.04,;-2.1,3.44,;-3.18,2.35,;-2.79,.86,;-1.3,.46,;-.21,1.55,;-3.87,-.23,;-5.41,-.07,;-6.03,-1.48,;-4.89,-2.51,;-4.89,-4.05,;-3.55,-4.82,;-2.22,-4.05,;-.76,-4.52,;.15,-3.28,;-.76,-2.03,;-2.22,-2.51,;-3.55,-1.74,)|

BDBM198537

C([C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)N1CCC(CC1)N1CCOCC1 |r,wU:4.7,wD:1.0,(-1.22,4.13,;-2.31,3.04,;-3.79,3.44,;-4.88,2.35,;-4.48,.86,;-3,.46,;-1.91,1.55,;-5.57,-.23,;-7.1,-.07,;-7.73,-1.48,;-6.59,-2.51,;-6.59,-4.05,;-5.25,-4.82,;-3.92,-4.05,;-2.45,-4.52,;-1.55,-3.28,;-2.45,-2.03,;-3.92,-2.51,;-5.25,-1.74,;.27,3.73,;1.36,4.82,;2.85,4.42,;3.26,2.93,;2.17,1.84,;.69,2.24,;4.75,2.54,;5.16,1.05,;6.65,.66,;7.73,1.76,;7.32,3.24,;5.84,3.63,)|

BDBM198538

CC(C)(C)OC(=O)N1CCC(CNC[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)CC1 |r,wU:17.20,wD:14.13,(8.46,2.08,;8.06,3.57,;9.15,4.66,;9.55,3.17,;6.58,3.97,;5.49,2.88,;5.89,1.39,;4,3.28,;2.91,2.19,;1.42,2.58,;1.03,4.07,;-.46,4.47,;-1.55,3.38,;-3.04,3.78,;-4.13,2.69,;-5.61,3.09,;-6.7,2,;-6.31,.51,;-4.82,.12,;-3.73,1.2,;-7.39,-.58,;-8.93,-.41,;-9.55,-1.82,;-8.41,-2.85,;-8.41,-4.39,;-7.07,-5.16,;-5.74,-4.39,;-4.28,-4.87,;-3.37,-3.62,;-4.28,-2.38,;-5.74,-2.85,;-7.07,-2.08,;2.11,5.16,;3.6,4.76,)|

BDBM198539

CC(C)(C)OC(=O)NCC1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)CC1 |r,wU:17.20,wD:14.13,(8.48,2.35,;8.07,3.83,;9.15,4.93,;9.56,3.44,;6.58,4.23,;5.5,3.13,;5.9,1.65,;4.01,3.52,;2.92,2.43,;1.44,2.82,;1.02,4.31,;-.47,4.7,;-1.56,3.61,;-3.04,4.01,;-4.13,2.92,;-5.62,3.32,;-6.71,2.23,;-6.31,.75,;-4.82,.35,;-3.73,1.44,;-7.4,-.34,;-8.93,-.18,;-9.56,-1.59,;-8.41,-2.62,;-8.41,-4.16,;-7.08,-4.93,;-5.75,-4.16,;-4.28,-4.63,;-3.38,-3.39,;-4.28,-2.14,;-5.75,-2.62,;-7.08,-1.85,;-1.14,2.13,;.35,1.73,)|

BDBM198540

CC(C)(C)OC(=O)N1CC[C@@H](C1)NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:17.21,wD:14.14,10.12,(6.93,7.16,;5.6,6.39,;5.6,4.85,;6.93,5.62,;4.26,7.16,;2.93,6.39,;1.6,7.16,;2.93,4.85,;4.18,3.94,;3.7,2.48,;2.16,2.48,;1.68,3.94,;1.07,1.39,;-.42,1.79,;-1.51,.7,;-2.99,1.1,;-4.08,.01,;-3.68,-1.48,;-2.2,-1.88,;-1.11,-.79,;-4.77,-2.57,;-6.3,-2.41,;-6.93,-3.82,;-5.79,-4.85,;-5.79,-6.39,;-4.45,-7.16,;-3.12,-6.39,;-1.65,-6.86,;-.75,-5.62,;-1.65,-4.37,;-3.12,-4.85,;-4.45,-4.08,)|

BDBM198541

FC1CN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:8.11,wD:5.4,(5.8,2.92,;4.31,3.32,;2.98,2.55,;2.21,3.89,;.72,4.29,;-.37,3.2,;-1.86,3.6,;-2.95,2.51,;-2.55,1.02,;-1.06,.62,;.03,1.71,;-3.64,-.07,;-5.17,.09,;-5.8,-1.32,;-4.65,-2.35,;-4.65,-3.89,;-3.32,-4.66,;-1.98,-3.89,;-.52,-4.36,;.39,-3.12,;-.52,-1.87,;-1.98,-2.35,;-3.32,-1.58,;3.54,4.66,)|

BDBM198542

FC1(F)CN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:9.12,wD:6.5,(5.4,2.23,;4.31,3.32,;5.8,3.72,;2.98,2.55,;2.21,3.89,;.72,4.29,;-.37,3.2,;-1.86,3.6,;-2.95,2.51,;-2.55,1.02,;-1.06,.62,;.03,1.71,;-3.64,-.07,;-5.17,.09,;-5.8,-1.32,;-4.65,-2.35,;-4.65,-3.89,;-3.32,-4.66,;-1.98,-3.89,;-.52,-4.36,;.39,-3.12,;-.52,-1.87,;-1.98,-2.35,;-3.32,-1.58,;3.54,4.66,)|

BDBM198543

CN(C)[C@@H]1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:11.14,wD:8.7,3.2,(6.58,3.12,;5.25,3.89,;5.25,5.43,;3.91,3.12,;3.44,1.65,;1.9,1.65,;1.42,3.12,;-.07,3.52,;-1.16,2.43,;-2.64,2.83,;-3.73,1.74,;-3.33,.25,;-1.85,-.15,;-.76,.94,;-4.42,-.84,;-5.95,-.68,;-6.58,-2.09,;-5.44,-3.12,;-5.44,-4.66,;-4.1,-5.43,;-2.77,-4.66,;-1.3,-5.13,;-.4,-3.89,;-1.3,-2.64,;-2.77,-3.12,;-4.1,-2.35,;2.67,4.02,)|

BDBM198544

FC(F)(F)CNC(=O)CNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:14.17,wD:11.10,(7.87,4.36,;6.38,4.76,;5.98,6.25,;7.47,5.85,;5.29,3.67,;3.8,4.07,;2.71,2.98,;3.11,1.5,;1.22,3.38,;.14,2.29,;-1.35,2.69,;-2.44,1.6,;-3.93,2,;-5.02,.91,;-4.62,-.58,;-3.13,-.97,;-2.04,.12,;-5.71,-1.66,;-7.24,-1.5,;-7.87,-2.91,;-6.72,-3.94,;-6.72,-5.48,;-5.39,-6.25,;-4.05,-5.48,;-2.59,-5.96,;-1.68,-4.71,;-2.59,-3.46,;-4.05,-3.94,;-5.39,-3.17,)|

BDBM198545

FC(F)(F)C(F)(F)CNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:13.16,wD:10.9,(6.38,4.76,;5.29,3.67,;5.69,2.19,;6.78,3.28,;3.8,4.07,;4.89,5.16,;4.2,2.58,;2.31,4.47,;1.22,3.38,;-.26,3.78,;-1.35,2.69,;-2.84,3.09,;-3.93,2,;-3.53,.51,;-2.04,.12,;-.95,1.2,;-4.62,-.58,;-6.15,-.41,;-6.78,-1.82,;-5.63,-2.85,;-5.63,-4.39,;-4.3,-5.16,;-2.96,-4.39,;-1.5,-4.87,;-.59,-3.62,;-1.5,-2.38,;-2.96,-2.85,;-4.3,-2.08,)|

BDBM198546

OC(CNC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)C(F)(F)F |r,wU:8.11,wD:5.4,(4.4,1.84,;4,3.33,;2.51,3.73,;1.42,2.64,;-.06,3.04,;-1.15,1.95,;-2.64,2.35,;-3.73,1.26,;-3.33,-.23,;-1.84,-.63,;-.75,.46,;-4.42,-1.32,;-5.95,-1.16,;-6.58,-2.56,;-5.43,-3.6,;-5.43,-5.14,;-4.1,-5.91,;-2.77,-5.14,;-1.3,-5.61,;-.4,-4.37,;-1.3,-3.12,;-2.77,-3.6,;-4.1,-2.83,;5.09,4.42,;4.69,5.91,;6.58,4.02,;6.18,5.51,)|

BDBM198547

C(NC1CSC1)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:9.13,wD:6.6,(1.2,3.36,;2.69,2.96,;3.78,4.05,;5.32,4.05,;5.32,5.59,;3.78,5.59,;.11,2.27,;-1.38,2.67,;-2.47,1.58,;-2.07,.09,;-.58,-.31,;.51,.78,;-3.16,-1,;-4.69,-.84,;-5.32,-2.25,;-4.17,-3.28,;-4.17,-4.82,;-2.84,-5.59,;-1.5,-4.82,;-.04,-5.29,;.87,-4.05,;-.04,-2.8,;-1.5,-3.28,;-2.84,-2.51,)|

BDBM198548

CCS(=O)(=O)N1CCN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)CC1 |r,wU:13.16,wD:10.9,(7.52,3.22,;6.03,3.62,;4.94,2.53,;4.55,1.04,;6.28,1.76,;3.46,2.93,;2.37,1.84,;.88,2.24,;.48,3.73,;-1.01,4.13,;-2.1,3.04,;-3.58,3.44,;-4.67,2.35,;-4.27,.86,;-2.79,.46,;-1.7,1.55,;-5.36,-.23,;-6.89,-.07,;-7.52,-1.48,;-6.38,-2.51,;-6.38,-4.05,;-5.04,-4.82,;-3.71,-4.05,;-2.24,-4.52,;-1.34,-3.28,;-2.24,-2.03,;-3.71,-2.51,;-5.04,-1.74,;1.57,4.82,;3.06,4.42,)|

BDBM198549

OC(CNC(=O)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)(c1ccccc1)C(F)(F)F |r,wU:9.12,wD:6.5,(3.06,1.3,;3.46,2.78,;1.97,3.18,;.88,2.09,;-.61,2.49,;-1.01,3.98,;-1.7,1.4,;-3.18,1.8,;-4.27,.71,;-3.87,-.77,;-2.39,-1.17,;-1.3,-.08,;-4.96,-1.86,;-6.5,-1.7,;-7.12,-3.11,;-5.98,-4.14,;-5.98,-5.68,;-4.64,-6.45,;-3.31,-5.68,;-1.85,-6.16,;-.94,-4.91,;-1.85,-3.66,;-3.31,-4.14,;-4.64,-3.37,;4.55,3.87,;6.03,3.47,;7.12,4.56,;6.72,6.05,;5.24,6.45,;4.15,5.36,;4.79,2.01,;6.12,2.78,;4.79,.47,;6.12,1.24,)|

BDBM198550

OC(CNC(=O)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)(c1ccc(F)cc1)C(F)(F)F |r,wU:9.12,wD:6.5,(2.71,.95,;3.11,2.44,;1.62,2.84,;.53,1.75,;-.95,2.15,;-1.35,3.63,;-2.04,1.06,;-3.53,1.46,;-4.62,.37,;-4.22,-1.12,;-2.73,-1.52,;-1.64,-.43,;-5.31,-2.21,;-6.84,-2.05,;-7.47,-3.45,;-6.32,-4.48,;-6.32,-6.02,;-4.99,-6.79,;-3.65,-6.02,;-2.19,-6.5,;-1.29,-5.25,;-2.19,-4.01,;-3.65,-4.48,;-4.99,-3.71,;4.2,3.53,;5.69,3.13,;6.78,4.22,;6.38,5.71,;7.47,6.79,;4.89,6.1,;3.8,5.02,;4.44,1.67,;5.78,2.44,;4.44,.13,;5.78,.9,)|

BDBM198551

NC(=O)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:6.9,wD:3.2,(4,3.33,;2.51,3.73,;2.11,5.21,;1.42,2.64,;-.06,3.04,;-1.15,1.95,;-.75,.46,;.73,.06,;1.82,1.15,;-1.84,-.63,;-3.37,-.47,;-4,-1.87,;-2.86,-2.9,;-2.86,-4.44,;-1.52,-5.21,;-.19,-4.44,;1.28,-4.92,;2.18,-3.67,;1.28,-2.43,;-.19,-2.9,;-1.52,-2.13,)|

BDBM198552

Cc1ccc(CNC(=O)[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)o1 |r,wU:12.15,wD:9.8,(7.14,5.39,;5.81,4.62,;5.81,3.08,;4.34,2.6,;3.44,3.85,;1.95,4.25,;.86,3.16,;-.63,3.56,;-1.03,5.04,;-1.72,2.47,;-3.2,2.86,;-4.29,1.78,;-3.89,.29,;-2.41,-.11,;-1.32,.98,;-4.98,-.8,;-6.51,-.64,;-7.14,-2.05,;-6,-3.08,;-6,-4.62,;-4.66,-5.39,;-3.33,-4.62,;-1.86,-5.09,;-.96,-3.85,;-1.86,-2.6,;-3.33,-3.08,;-4.66,-2.31,;4.34,5.09,)|

BDBM198553

O=C(NCc1ccc(cc1)C#N)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:15.19,wD:12.12,(-2.15,5.21,;-1.75,3.73,;-.26,3.33,;.83,4.42,;2.31,4.02,;2.71,2.53,;4.2,2.13,;5.29,3.22,;4.89,4.71,;3.4,5.11,;6.78,2.82,;8.26,2.42,;-2.84,2.64,;-4.33,3.04,;-5.42,1.95,;-5.02,.46,;-3.53,.06,;-2.44,1.15,;-6.11,-.63,;-7.64,-.47,;-8.26,-1.87,;-7.12,-2.9,;-7.12,-4.44,;-5.79,-5.21,;-4.45,-4.44,;-2.99,-4.92,;-2.08,-3.67,;-2.99,-2.43,;-4.45,-2.9,;-5.79,-2.13,)|

BDBM198554

O=C(NC(C#N)c1ccccc1)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:15.19,wD:12.12,(-.66,4.13,;-.26,2.64,;1.22,2.24,;2.31,3.33,;1.92,4.82,;1.52,6.3,;3.8,2.93,;4.2,1.44,;5.69,1.04,;6.78,2.13,;6.38,3.62,;4.89,4.02,;-1.35,1.55,;-2.84,1.95,;-3.93,.86,;-3.53,-.63,;-2.04,-1.03,;-.95,.06,;-4.62,-1.72,;-6.15,-1.56,;-6.78,-2.96,;-5.63,-3.99,;-5.63,-5.53,;-4.3,-6.3,;-2.96,-5.53,;-1.5,-6.01,;-.59,-4.76,;-1.5,-3.52,;-2.96,-3.99,;-4.3,-3.22,)|

BDBM198555

Clc1ccc(CCNC(=O)[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:13.16,wD:10.9,(7.47,6.79,;6.38,5.71,;6.78,4.22,;5.69,3.13,;4.2,3.53,;3.11,2.44,;1.62,2.84,;.53,1.75,;-.95,2.15,;-1.35,3.63,;-2.04,1.06,;-3.53,1.46,;-4.62,.37,;-4.22,-1.12,;-2.73,-1.52,;-1.64,-.43,;-5.31,-2.21,;-6.84,-2.05,;-7.47,-3.45,;-6.32,-4.48,;-6.32,-6.02,;-4.99,-6.79,;-3.65,-6.02,;-2.19,-6.5,;-1.29,-5.25,;-2.19,-4.01,;-3.65,-4.48,;-4.99,-3.71,;3.8,5.02,;4.89,6.1,)|

BDBM198556

O[C@H](CNC(=O)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)c1ccccc1 |r,wU:9.12,wD:6.5,1.0,(3.85,1.3,;3.46,2.78,;1.97,3.18,;.88,2.09,;-.61,2.49,;-1.01,3.98,;-1.7,1.4,;-3.18,1.8,;-4.27,.71,;-3.87,-.77,;-2.39,-1.17,;-1.3,-.08,;-4.96,-1.86,;-6.5,-1.7,;-7.12,-3.11,;-5.98,-4.14,;-5.98,-5.68,;-4.64,-6.45,;-3.31,-5.68,;-1.85,-6.16,;-.94,-4.91,;-1.85,-3.66,;-3.31,-4.14,;-4.64,-3.37,;4.55,3.87,;6.03,3.47,;7.12,4.56,;6.72,6.05,;5.24,6.45,;4.15,5.36,)|

BDBM198557

FC(F)(F)CNC(=O)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:11.14,wD:8.7,(4.94,2.53,;4.55,4.02,;5.63,5.11,;6.03,3.62,;3.06,4.42,;1.97,3.33,;.48,3.73,;.08,5.21,;-.61,2.64,;-2.1,3.04,;-3.18,1.95,;-2.79,.46,;-1.3,.06,;-.21,1.15,;-3.87,-.63,;-5.41,-.47,;-6.03,-1.87,;-4.89,-2.9,;-4.89,-4.44,;-3.55,-5.21,;-2.22,-4.44,;-.76,-4.92,;.15,-3.67,;-.76,-2.43,;-2.22,-2.9,;-3.55,-2.13,)|

BDBM198558

O=C(NCC#N)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:9.12,wD:6.5,(.08,5.21,;.48,3.73,;1.97,3.33,;3.06,4.42,;4.55,4.02,;6.03,3.62,;-.61,2.64,;-2.1,3.04,;-3.18,1.95,;-2.79,.46,;-1.3,.06,;-.21,1.15,;-3.87,-.63,;-5.41,-.47,;-6.03,-1.87,;-4.89,-2.9,;-4.89,-4.44,;-3.55,-5.21,;-2.22,-4.44,;-.76,-4.92,;.15,-3.67,;-.76,-2.43,;-2.22,-2.9,;-3.55,-2.13,)|

BDBM198559

O=C(NCCC#N)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:10.13,wD:7.6,(-.26,4.72,;.14,3.24,;1.62,2.84,;2.71,3.93,;4.2,3.53,;5.29,4.62,;6.38,5.71,;-.95,2.15,;-2.44,2.55,;-3.53,1.46,;-3.13,-.03,;-1.64,-.43,;-.55,.66,;-4.22,-1.12,;-5.75,-.96,;-6.38,-2.37,;-5.23,-3.4,;-5.23,-4.94,;-3.9,-5.71,;-2.57,-4.94,;-1.1,-5.41,;-.2,-4.17,;-1.1,-2.92,;-2.57,-3.4,;-3.9,-2.63,)|

BDBM198560

O=C([C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)N1CC[C@@H](C1)C#N |r,wU:5.8,23.29,wD:2.1,(-.4,5,;-.01,3.52,;-1.09,2.43,;-2.58,2.83,;-3.67,1.74,;-3.27,.25,;-1.78,-.15,;-.7,.94,;-4.36,-.84,;-5.89,-.68,;-6.52,-2.09,;-5.37,-3.12,;-5.37,-4.66,;-4.04,-5.43,;-2.71,-4.66,;-1.24,-5.13,;-.34,-3.89,;-1.24,-2.64,;-2.71,-3.12,;-4.04,-2.35,;1.48,3.12,;2.39,1.87,;3.85,2.35,;3.85,3.89,;2.39,4.36,;5.19,4.66,;6.52,5.43,)|

BDBM198561

O[C@H]1CCN(C1)C(=O)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:11.15,1.0,wD:8.8,(5.85,4.87,;4.52,4.1,;4.52,2.56,;3.05,2.08,;2.15,3.33,;3.05,4.57,;.66,3.73,;.26,5.21,;-.43,2.64,;-1.92,3.04,;-3,1.95,;-2.61,.46,;-1.12,.06,;-.03,1.15,;-3.69,-.63,;-5.23,-.47,;-5.85,-1.87,;-4.71,-2.9,;-4.71,-4.44,;-3.37,-5.21,;-2.04,-4.44,;-.58,-4.92,;.33,-3.67,;-.58,-2.43,;-2.04,-2.9,;-3.37,-2.13,)|

BDBM198562

O=C(NC1CC1)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:9.13,wD:6.6,(.83,4.87,;1.22,3.38,;2.71,2.98,;3.8,4.07,;5.29,4.47,;4.2,5.56,;.14,2.29,;-1.35,2.69,;-2.44,1.6,;-2.04,.12,;-.55,-.28,;.53,.81,;-3.13,-.97,;-4.66,-.81,;-5.29,-2.22,;-4.14,-3.25,;-4.14,-4.79,;-2.81,-5.56,;-1.48,-4.79,;-.01,-5.27,;.89,-4.02,;-.01,-2.77,;-1.48,-3.25,;-2.81,-2.48,)|

BDBM198563

OCCNC(=O)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:9.12,wD:6.5,(5.83,5.11,;4.74,4.02,;3.26,4.42,;2.17,3.33,;.68,3.73,;.28,5.21,;-.41,2.64,;-1.9,3.04,;-2.98,1.95,;-2.59,.46,;-1.1,.06,;-.01,1.15,;-3.68,-.63,;-5.21,-.47,;-5.83,-1.87,;-4.69,-2.9,;-4.69,-4.44,;-3.36,-5.21,;-2.02,-4.44,;-.56,-4.92,;.35,-3.67,;-.56,-2.43,;-2.02,-2.9,;-3.36,-2.13,)|

BDBM198564

OC1CN(C1)C(=O)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:10.14,wD:7.7,(5.8,2.37,;4.31,2.77,;2.98,2,;2.21,3.33,;3.54,4.1,;.72,3.73,;.32,5.21,;-.37,2.64,;-1.86,3.04,;-2.95,1.95,;-2.55,.46,;-1.06,.06,;.03,1.15,;-3.64,-.63,;-5.17,-.47,;-5.8,-1.87,;-4.65,-2.9,;-4.65,-4.44,;-3.32,-5.21,;-1.98,-4.44,;-.52,-4.92,;.39,-3.67,;-.52,-2.43,;-1.98,-2.9,;-3.32,-2.13,)|

BDBM198565

O=C(NCCc1ccc(cc1)C#N)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:16.20,wD:13.13,(-1.9,3.09,;-1.5,1.6,;-.01,1.2,;1.08,2.29,;2.57,1.89,;3.66,2.98,;5.14,2.58,;6.23,3.67,;5.83,5.16,;4.35,5.56,;3.26,4.47,;6.92,6.25,;8.01,7.34,;-2.59,.51,;-4.07,.91,;-5.16,-.18,;-4.76,-1.66,;-3.28,-2.06,;-2.19,-.97,;-5.85,-2.75,;-7.38,-2.59,;-8.01,-4,;-6.87,-5.03,;-6.87,-6.57,;-5.53,-7.34,;-4.2,-6.57,;-2.73,-7.05,;-1.83,-5.8,;-2.73,-4.55,;-4.2,-5.03,;-5.53,-4.26,)|

BDBM198566

O=C([C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)N1CC(C1)C#N |r,wU:5.8,wD:2.1,(-.42,5.21,;-.03,3.73,;-1.12,2.64,;-2.6,3.04,;-3.69,1.95,;-3.29,.46,;-1.81,.06,;-.72,1.15,;-4.38,-.63,;-5.91,-.47,;-6.54,-1.87,;-5.4,-2.9,;-5.4,-4.44,;-4.06,-5.21,;-2.73,-4.44,;-1.26,-4.92,;-.36,-3.67,;-1.26,-2.43,;-2.73,-2.9,;-4.06,-2.13,;1.46,3.33,;2.23,2,;3.56,2.77,;2.79,4.1,;5.05,2.37,;6.54,1.97,)|

BDBM198567

O=C(NCS(=O)(=O)c1ccccc1)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:16.20,wD:13.13,(-1.01,3.98,;-.61,2.49,;.88,2.09,;1.97,3.18,;3.46,2.78,;3.06,1.3,;4.55,1.7,;4.55,3.87,;6.03,3.47,;7.12,4.56,;6.72,6.05,;5.24,6.45,;4.15,5.36,;-1.7,1.4,;-3.18,1.8,;-4.27,.71,;-3.87,-.77,;-2.39,-1.17,;-1.3,-.08,;-4.96,-1.86,;-6.5,-1.7,;-7.12,-3.11,;-5.98,-4.14,;-5.98,-5.68,;-4.64,-6.45,;-3.31,-5.68,;-1.85,-6.16,;-.94,-4.91,;-1.85,-3.66,;-3.31,-4.14,;-4.64,-3.37,)|

BDBM198568

Fc1ccc(cc1)S(=O)(=O)C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:14.18,wD:11.11,(6.18,6.45,;5.09,5.36,;5.49,3.87,;4.4,2.78,;2.91,3.18,;2.51,4.67,;3.6,5.76,;1.82,2.09,;1.42,.61,;3.16,1.32,;.34,2.49,;-.75,1.4,;-2.24,1.8,;-3.33,.71,;-2.93,-.77,;-1.44,-1.17,;-.36,-.08,;-4.02,-1.86,;-5.55,-1.7,;-6.18,-3.11,;-5.03,-4.14,;-5.03,-5.68,;-3.7,-6.45,;-2.37,-5.68,;-.9,-6.16,;0,-4.91,;-.9,-3.66,;-2.37,-4.14,;-3.7,-3.37,)|

BDBM198569

O=S(=O)(C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)C1CC1 |r,wU:7.10,wD:4.3,(2.31,1.5,;2.71,2.98,;3.8,1.89,;1.22,3.38,;.14,2.29,;-1.35,2.69,;-2.44,1.6,;-2.04,.12,;-.55,-.28,;.53,.81,;-3.13,-.97,;-4.66,-.81,;-5.29,-2.22,;-4.14,-3.25,;-4.14,-4.79,;-2.81,-5.56,;-1.48,-4.79,;-.01,-5.27,;.89,-4.02,;-.01,-2.77,;-1.48,-3.25,;-2.81,-2.48,;3.8,4.07,;5.29,4.47,;4.2,5.56,)|

BDBM198570

IC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:5.8,wD:2.1,(4,4.07,;2.51,4.47,;1.42,3.38,;-.06,3.78,;-1.15,2.69,;-.75,1.2,;.73,.81,;1.82,1.89,;-1.84,.12,;-3.37,.28,;-4,-1.13,;-2.86,-2.16,;-2.86,-3.7,;-1.52,-4.47,;-.19,-3.7,;1.28,-4.18,;2.18,-2.93,;1.28,-1.69,;-.19,-2.16,;-1.52,-1.39,)|

BDBM198571

FC(F)(F)S(=O)(=O)C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:11.14,wD:8.7,(5.29,3.67,;3.8,4.07,;3.4,5.56,;4.89,5.16,;2.71,2.98,;2.31,1.5,;4.05,2.21,;1.22,3.38,;.14,2.29,;-1.35,2.69,;-2.44,1.6,;-2.04,.12,;-.55,-.28,;.53,.81,;-3.13,-.97,;-4.66,-.81,;-5.29,-2.22,;-4.14,-3.25,;-4.14,-4.79,;-2.81,-5.56,;-1.48,-4.79,;-.01,-5.27,;.89,-4.02,;-.01,-2.77,;-1.48,-3.25,;-2.81,-2.48,)|

BDBM198572

[N-]=[N+]=NC[C@@H]4CC[C@@H](c2nnn3cnc1[nH]ccc1c23)CC4

BDBM198573

CC(C)(O)c1cn(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)nn1 |r,wU:11.14,wD:8.7,(4.42,5.71,;5.19,4.37,;5.96,5.71,;6.52,3.6,;3.85,3.6,;2.39,4.08,;1.48,2.83,;-.01,3.23,;-1.09,2.14,;-2.58,2.54,;-3.67,1.45,;-3.27,-.03,;-1.78,-.43,;-.7,.66,;-4.36,-1.12,;-5.89,-.96,;-6.52,-2.37,;-5.37,-3.4,;-5.37,-4.94,;-4.04,-5.71,;-2.71,-4.94,;-1.24,-5.41,;-.34,-4.17,;-1.24,-2.92,;-2.71,-3.4,;-4.04,-2.63,;2.39,1.59,;3.85,2.06,)|

BDBM198574

NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:5.8,wD:2.1,(4,4.07,;2.51,4.47,;1.42,3.38,;-.06,3.78,;-1.15,2.69,;-.75,1.2,;.73,.81,;1.82,1.89,;-1.84,.12,;-3.37,.28,;-4,-1.13,;-2.86,-2.16,;-2.86,-3.7,;-1.52,-4.47,;-.19,-3.7,;1.28,-4.18,;2.18,-2.93,;1.28,-1.69,;-.19,-2.16,;-1.52,-1.39,)|

BDBM198575

O=C(CC#N)NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:10.13,wD:7.6,(2.31,5.41,;2.71,3.93,;4.2,3.53,;5.29,4.62,;6.38,5.71,;1.62,2.84,;.14,3.24,;-.95,2.15,;-2.44,2.55,;-3.53,1.46,;-3.13,-.03,;-1.64,-.43,;-.55,.66,;-4.22,-1.12,;-5.75,-.96,;-6.38,-2.37,;-5.23,-3.4,;-5.23,-4.94,;-3.9,-5.71,;-2.57,-4.94,;-1.1,-5.41,;-.2,-4.17,;-1.1,-2.92,;-2.57,-3.4,;-3.9,-2.63,)|

BDBM198576

FC(F)(F)CC(=O)NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:12.15,wD:9.8,(6.58,4.02,;5.09,4.42,;4.69,5.91,;6.18,5.51,;4,3.33,;2.51,3.73,;2.11,5.21,;1.42,2.64,;-.06,3.04,;-1.15,1.95,;-2.64,2.35,;-3.73,1.26,;-3.33,-.23,;-1.84,-.63,;-.75,.46,;-4.42,-1.32,;-5.95,-1.16,;-6.58,-2.56,;-5.43,-3.6,;-5.43,-5.14,;-4.1,-5.91,;-2.77,-5.14,;-1.3,-5.61,;-.4,-4.37,;-1.3,-3.12,;-2.77,-3.6,;-4.1,-2.83,)|

BDBM198577

Cc1c(CN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)c(Cl)nn1CC(F)(F)F

BDBM198578

N#Cc1ccc(CCN2CCC(CC2)c2nnn3cnc4[nH]ccc4c23)cc1

BDBM198579

N#Cc1ccc(cc1)N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198580

Clc1c[nH]c2ncn3nnc(C4CCN(Cc5ccc(cc5)C#N)CC4)c3c12

BDBM198581

O[C@H]1Cc2ccccc2[C@H]1NC1CCC(CC1)c1nnn2cnc3[nH]ccc3c12 |r,wD:9.11,1.0,(1.95,-.14,;2.72,1.19,;4.25,1.36,;4.57,2.86,;5.91,3.63,;5.91,5.17,;4.57,5.94,;3.24,5.17,;3.24,3.63,;2.09,2.6,;.61,3,;-.48,1.91,;-.08,.42,;-1.17,-.67,;-2.66,-.27,;-3.06,1.22,;-1.97,2.31,;-3.75,-1.36,;-5.28,-1.19,;-5.91,-2.6,;-4.76,-3.63,;-4.76,-5.17,;-3.43,-5.94,;-2.09,-5.17,;-.63,-5.65,;.28,-4.4,;-.63,-3.16,;-2.09,-3.63,;-3.43,-2.86,)|

BDBM198582

O[C@@H]1Cc2ccccc2[C@@H]1NC1CCC(CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:9.11,1.0,(1.95,-.14,;2.72,1.19,;4.25,1.36,;4.57,2.86,;5.91,3.63,;5.91,5.17,;4.57,5.94,;3.24,5.17,;3.24,3.63,;2.09,2.6,;.61,3,;-.48,1.91,;-.08,.42,;-1.17,-.67,;-2.66,-.27,;-3.06,1.22,;-1.97,2.31,;-3.75,-1.36,;-5.28,-1.19,;-5.91,-2.6,;-4.76,-3.63,;-4.76,-5.17,;-3.43,-5.94,;-2.09,-5.17,;-.63,-5.65,;.28,-4.4,;-.63,-3.16,;-2.09,-3.63,;-3.43,-2.86,)|

BDBM198583

N#CCCN(CCC#N)C1CCC(CC1)c1nnn2cnc3[nH]ccc3c12 |(4.49,4.96,;3,5.36,;1.52,5.76,;.43,4.67,;.83,3.18,;2.31,2.78,;2.71,1.3,;4.2,.9,;5.69,.5,;-.26,2.09,;.14,.61,;-.95,-.48,;-2.44,-.08,;-2.84,1.4,;-1.75,2.49,;-3.53,-1.17,;-5.06,-1.01,;-5.69,-2.42,;-4.54,-3.45,;-4.54,-4.99,;-3.21,-5.76,;-1.88,-4.99,;-.41,-5.47,;.49,-4.22,;-.41,-2.97,;-1.88,-3.45,;-3.21,-2.68,)|

BDBM198584

Fc1ccc(N[C@H]2CC[C@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:9.12,6.5,(6.23,2.53,;4.74,2.93,;3.66,1.84,;2.17,2.24,;1.77,3.73,;.28,4.13,;-.81,3.04,;-.41,1.55,;-1.5,.46,;-2.98,.86,;-3.38,2.35,;-2.29,3.44,;-4.07,-.23,;-5.61,-.07,;-6.23,-1.48,;-5.09,-2.51,;-5.09,-4.05,;-3.75,-4.82,;-2.42,-4.05,;-.96,-4.52,;-.05,-3.28,;-.96,-2.03,;-2.42,-2.51,;-3.75,-1.74,;2.86,4.82,;4.35,4.42,)|

BDBM198585

Fc1ccc(N[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:9.12,wD:6.5,(6.23,2.53,;4.74,2.93,;3.66,1.84,;2.17,2.24,;1.77,3.73,;.28,4.13,;-.81,3.04,;-2.29,3.44,;-3.38,2.35,;-2.98,.86,;-1.5,.46,;-.41,1.55,;-4.07,-.23,;-5.61,-.07,;-6.23,-1.48,;-5.09,-2.51,;-5.09,-4.05,;-3.75,-4.82,;-2.42,-4.05,;-.96,-4.52,;-.05,-3.28,;-.96,-2.03,;-2.42,-2.51,;-3.75,-1.74,;2.86,4.82,;4.35,4.42,)|

BDBM198586

FC(F)(Br)CN[C@H]1CC[C@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:9.12,6.5,(5.29,3.67,;3.8,4.07,;3.4,5.56,;4.89,5.16,;2.71,2.98,;1.22,3.38,;.14,2.29,;.53,.81,;-.55,-.28,;-2.04,.12,;-2.44,1.6,;-1.35,2.69,;-3.13,-.97,;-4.66,-.81,;-5.29,-2.22,;-4.14,-3.25,;-4.14,-4.79,;-2.81,-5.56,;-1.48,-4.79,;-.01,-5.27,;.89,-4.02,;-.01,-2.77,;-1.48,-3.25,;-2.81,-2.48,)|

BDBM198587

FC(F)(Br)CN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:9.12,wD:6.5,(5.29,3.67,;3.8,4.07,;3.4,5.56,;4.89,5.16,;2.71,2.98,;1.22,3.38,;.14,2.29,;-1.35,2.69,;-2.44,1.6,;-2.04,.12,;-.55,-.28,;.53,.81,;-3.13,-.97,;-4.66,-.81,;-5.29,-2.22,;-4.14,-3.25,;-4.14,-4.79,;-2.81,-5.56,;-1.48,-4.79,;-.01,-5.27,;.89,-4.02,;-.01,-2.77,;-1.48,-3.25,;-2.81,-2.48,)|

BDBM198588

FC(F)(F)C(F)(F)CN[C@H]1CC[C@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:12.15,9.8,(3.95,6.1,;4.35,4.62,;5.83,4.22,;5.43,5.71,;3.26,3.53,;4.74,3.13,;2.86,5.02,;2.17,2.44,;.68,2.84,;-.41,1.75,;-.01,.26,;-1.1,-.83,;-2.59,-.43,;-2.98,1.06,;-1.9,2.15,;-3.68,-1.52,;-5.21,-1.36,;-5.83,-2.76,;-4.69,-3.79,;-4.69,-5.33,;-3.36,-6.1,;-2.02,-5.33,;-.56,-5.81,;.35,-4.56,;-.56,-3.32,;-2.02,-3.79,;-3.36,-3.02,)|

BDBM198589

FC(F)(F)C(F)(F)CN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:12.15,wD:9.8,(3.95,6.1,;4.35,4.62,;5.83,4.22,;5.43,5.71,;3.26,3.53,;4.74,3.13,;2.86,5.02,;2.17,2.44,;.68,2.84,;-.41,1.75,;-1.9,2.15,;-2.98,1.06,;-2.59,-.43,;-1.1,-.83,;-.01,.26,;-3.68,-1.52,;-5.21,-1.36,;-5.83,-2.76,;-4.69,-3.79,;-4.69,-5.33,;-3.36,-6.1,;-2.02,-5.33,;-.56,-5.81,;.35,-4.56,;-.56,-3.32,;-2.02,-3.79,;-3.36,-3.02,)|

BDBM198590

FC(F)(F)CNC(=O)CN[C@H]1CC[C@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:13.16,10.9,(6.92,5.45,;5.83,4.36,;6.23,2.88,;7.32,3.97,;4.35,4.76,;3.26,3.67,;1.77,4.07,;1.37,5.56,;.68,2.98,;-.81,3.38,;-1.9,2.29,;-1.5,.81,;-2.59,-.28,;-4.07,.12,;-4.47,1.6,;-3.38,2.69,;-5.16,-.97,;-6.69,-.81,;-7.32,-2.22,;-6.18,-3.25,;-6.18,-4.79,;-4.84,-5.56,;-3.51,-4.79,;-2.04,-5.27,;-1.14,-4.02,;-2.04,-2.77,;-3.51,-3.25,;-4.84,-2.48,)|

BDBM198591

FC(F)(F)CNC(=O)CN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:13.16,wD:10.9,(6.92,5.45,;5.83,4.36,;6.23,2.88,;7.32,3.97,;4.35,4.76,;3.26,3.67,;1.77,4.07,;1.37,5.56,;.68,2.98,;-.81,3.38,;-1.9,2.29,;-3.38,2.69,;-4.47,1.6,;-4.07,.12,;-2.59,-.28,;-1.5,.81,;-5.16,-.97,;-6.69,-.81,;-7.32,-2.22,;-6.18,-3.25,;-6.18,-4.79,;-4.84,-5.56,;-3.51,-4.79,;-2.04,-5.27,;-1.14,-4.02,;-2.04,-2.77,;-3.51,-3.25,;-4.84,-2.48,)|

BDBM198657

OC(CN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)(c1cccnc1)C(F)(F)F |r,wU:4.3,wD:7.10,(7.37,-10.27,;5.87,-10.59,;5.55,-9.09,;4.08,-8.61,;3.76,-7.1,;2.3,-6.63,;1.98,-5.12,;3.12,-4.09,;4.59,-4.57,;4.91,-6.07,;2.8,-2.58,;1.4,-1.96,;1.56,-.43,;3.06,-.11,;3.83,1.23,;5.37,1.23,;6.14,-.11,;7.65,-.43,;7.81,-1.96,;6.4,-2.58,;5.37,-1.44,;3.83,-1.44,;6.19,-12.1,;5.04,-13.13,;5.36,-14.64,;6.83,-15.11,;7.97,-14.08,;7.65,-12.57,;4.36,-10.91,;2.86,-11.23,;4.68,-12.42,;4.04,-9.41,)|

BDBM198593

CSc1ccc(cc1)C(O)(CN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)C(F)(F)F |r,wU:15.19,wD:12.12,(7.72,.4,;7.32,1.89,;5.83,2.29,;4.74,1.2,;3.26,1.6,;2.86,3.08,;3.95,4.17,;5.43,3.77,;1.37,3.48,;.28,4.57,;.28,2.39,;-1.21,2.79,;-2.29,1.7,;-3.78,2.1,;-4.87,1.01,;-4.47,-.47,;-2.98,-.87,;-1.9,.22,;-5.56,-1.56,;-7.09,-1.4,;-7.72,-2.81,;-6.57,-3.84,;-6.57,-5.38,;-5.24,-6.15,;-3.91,-5.38,;-2.44,-5.86,;-1.54,-4.61,;-2.44,-3.36,;-3.91,-3.84,;-5.24,-3.07,;2.14,4.82,;3.68,4.82,;1.37,6.15,;2.91,6.15,)|

BDBM198594

COc1ccc(cn1)C(O)(CN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)C(F)(F)F |r,wU:15.19,wD:12.12,(7.72,.4,;7.32,1.89,;5.83,2.29,;5.43,3.77,;3.95,4.17,;2.86,3.08,;3.26,1.6,;4.74,1.2,;1.37,3.48,;.28,4.57,;.28,2.39,;-1.21,2.79,;-2.29,1.7,;-3.78,2.1,;-4.87,1.01,;-4.47,-.47,;-2.98,-.87,;-1.9,.22,;-5.56,-1.56,;-7.09,-1.4,;-7.72,-2.81,;-6.57,-3.84,;-6.57,-5.38,;-5.24,-6.15,;-3.91,-5.38,;-2.44,-5.86,;-1.54,-4.61,;-2.44,-3.36,;-3.91,-3.84,;-5.24,-3.07,;2.14,4.82,;3.68,4.82,;1.37,6.15,;2.91,6.15,)|

BDBM198595

COc1ccc(cc1)C(O)(CN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)C(F)(F)F |r,wU:15.19,wD:12.12,(7.72,.4,;7.32,1.89,;5.83,2.29,;4.74,1.2,;3.26,1.6,;2.86,3.08,;3.95,4.17,;5.43,3.77,;1.37,3.48,;.28,4.57,;.28,2.39,;-1.21,2.79,;-2.29,1.7,;-3.78,2.1,;-4.87,1.01,;-4.47,-.47,;-2.98,-.87,;-1.9,.22,;-5.56,-1.56,;-7.09,-1.4,;-7.72,-2.81,;-6.57,-3.84,;-6.57,-5.38,;-5.24,-6.15,;-3.91,-5.38,;-2.44,-5.86,;-1.54,-4.61,;-2.44,-3.36,;-3.91,-3.84,;-5.24,-3.07,;2.14,4.82,;3.68,4.82,;1.37,6.15,;2.91,6.15,)|

BDBM198596

Fc1ccc(cc1)[C@@H]1C[C@H]1CN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:15.20,7.7,wD:12.13,9.11,(6.83,7.68,;6.06,6.35,;6.83,5.02,;6.06,3.68,;4.52,3.68,;3.75,5.02,;4.52,6.35,;3.75,2.35,;2.66,3.44,;2.26,1.95,;1.17,.86,;-.32,1.26,;-1.4,.17,;-2.89,.57,;-3.98,-.52,;-3.58,-2.01,;-2.09,-2.41,;-1.01,-1.32,;-4.67,-3.1,;-6.2,-2.94,;-6.83,-4.34,;-5.68,-5.37,;-5.68,-6.91,;-4.35,-7.68,;-3.02,-6.91,;-1.55,-7.39,;-.65,-6.14,;-1.55,-4.9,;-3.02,-5.37,;-4.35,-4.6,)|

BDBM198597

COc1ccc(cc1OC)C(O)(CN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)C(F)(F)F |r,wU:17.21,wD:14.14,(7.72,.4,;7.32,1.89,;5.83,2.29,;5.43,3.77,;3.95,4.17,;2.86,3.08,;3.26,1.6,;4.74,1.2,;5.14,-.29,;6.63,-.69,;1.37,3.48,;.28,4.57,;.28,2.39,;-1.21,2.79,;-2.29,1.7,;-3.78,2.1,;-4.87,1.01,;-4.47,-.47,;-2.98,-.87,;-1.9,.22,;-5.56,-1.56,;-7.09,-1.4,;-7.72,-2.81,;-6.57,-3.84,;-6.57,-5.38,;-5.24,-6.15,;-3.91,-5.38,;-2.44,-5.86,;-1.54,-4.61,;-2.44,-3.36,;-3.91,-3.84,;-5.24,-3.07,;2.14,4.82,;3.68,4.82,;1.37,6.15,;2.91,6.15,)|

BDBM198598

N#Cc1ccc(CCN[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)cc1 |r,wU:12.15,wD:9.8,(8.26,2.48,;6.78,2.88,;5.29,3.28,;4.2,2.19,;2.71,2.58,;2.31,4.07,;.83,4.47,;-.26,3.38,;-1.75,3.78,;-2.84,2.69,;-4.33,3.09,;-5.42,2,;-5.02,.51,;-3.53,.12,;-2.44,1.2,;-6.11,-.58,;-7.64,-.41,;-8.26,-1.82,;-7.12,-2.85,;-7.12,-4.39,;-5.79,-5.16,;-4.45,-4.39,;-2.99,-4.87,;-2.08,-3.62,;-2.99,-2.38,;-4.45,-2.85,;-5.79,-2.08,;3.4,5.16,;4.89,4.76,)|

BDBM198599

C1CC1N[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:7.11,wD:4.4,(4.35,2.98,;4.74,4.47,;3.26,4.07,;1.77,4.47,;.68,3.38,;-.81,3.78,;-1.9,2.69,;-1.5,1.2,;-.01,.81,;1.08,1.89,;-2.59,.12,;-4.12,.28,;-4.74,-1.13,;-3.6,-2.16,;-3.6,-3.7,;-2.27,-4.47,;-.93,-3.7,;.53,-4.18,;1.44,-2.93,;.53,-1.69,;-.93,-2.16,;-2.27,-1.39,)|

BDBM198600

N#CCN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:7.10,wD:4.3,(5.09,5.36,;4,4.27,;2.91,3.18,;1.42,3.58,;.34,2.49,;-1.15,2.89,;-2.24,1.8,;-1.84,.31,;-.36,-.08,;.73,1.01,;-2.93,-.77,;-4.46,-.61,;-5.09,-2.02,;-3.95,-3.05,;-3.95,-4.59,;-2.61,-5.36,;-1.28,-4.59,;.19,-5.07,;1.09,-3.82,;.19,-2.57,;-1.28,-3.05,;-2.61,-2.28,)|

BDBM198601

N#CCCN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:8.11,wD:5.4,(6.03,4.02,;4.55,4.42,;3.06,4.82,;1.97,3.73,;.48,4.13,;-.61,3.04,;-2.1,3.44,;-3.18,2.35,;-2.79,.86,;-1.3,.46,;-.21,1.55,;-3.87,-.23,;-5.41,-.07,;-6.03,-1.48,;-4.89,-2.51,;-4.89,-4.05,;-3.55,-4.82,;-2.22,-4.05,;-.76,-4.52,;.15,-3.28,;-.76,-2.03,;-2.22,-2.51,;-3.55,-1.74,)|

BDBM198602

FC(F)(F)CN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:9.12,wD:6.5,(5.29,3.67,;3.8,4.07,;3.4,5.56,;4.89,5.16,;2.71,2.98,;1.22,3.38,;.14,2.29,;-1.35,2.69,;-2.44,1.6,;-2.04,.12,;-.55,-.28,;.53,.81,;-3.13,-.97,;-4.66,-.81,;-5.29,-2.22,;-4.14,-3.25,;-4.14,-4.79,;-2.81,-5.56,;-1.48,-4.79,;-.01,-5.27,;.89,-4.02,;-.01,-2.77,;-1.48,-3.25,;-2.81,-2.48,)|

BDBM198603

C(N[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)C1CC1 |r,wU:5.8,wD:2.1,(2.71,2.98,;1.22,3.38,;.14,2.29,;-1.35,2.69,;-2.44,1.6,;-2.04,.12,;-.55,-.28,;.53,.81,;-3.13,-.97,;-4.66,-.81,;-5.29,-2.22,;-4.14,-3.25,;-4.14,-4.79,;-2.81,-5.56,;-1.48,-4.79,;-.01,-5.27,;.89,-4.02,;-.01,-2.77,;-1.48,-3.25,;-2.81,-2.48,;3.8,4.07,;5.29,4.47,;4.2,5.56,)|

BDBM198604

CN(C)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:6.9,wD:3.2,(4,3.33,;2.51,3.73,;2.11,5.21,;1.42,2.64,;-.06,3.04,;-1.15,1.95,;-.75,.46,;.73,.06,;1.82,1.15,;-1.84,-.63,;-3.37,-.47,;-4,-1.87,;-2.86,-2.9,;-2.86,-4.44,;-1.52,-5.21,;-.19,-4.44,;1.28,-4.92,;2.18,-3.67,;1.28,-2.43,;-.19,-2.9,;-1.52,-2.13,)|

BDBM198605

CN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:5.8,wD:2.1,(4,4.07,;2.51,4.47,;1.42,3.38,;-.06,3.78,;-1.15,2.69,;-.75,1.2,;.73,.81,;1.82,1.89,;-1.84,.12,;-3.37,.28,;-4,-1.13,;-2.86,-2.16,;-2.86,-3.7,;-1.52,-4.47,;-.19,-3.7,;1.28,-4.18,;2.18,-2.93,;1.28,-1.69,;-.19,-2.16,;-1.52,-1.39,)|

BDBM198606

FC(F)CN[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:8.11,wD:5.4,(5.29,3.67,;3.8,4.07,;3.4,5.56,;2.71,2.98,;1.22,3.38,;.14,2.29,;-1.35,2.69,;-2.44,1.6,;-2.04,.12,;-.55,-.28,;.53,.81,;-3.13,-.97,;-4.66,-.81,;-5.29,-2.22,;-4.14,-3.25,;-4.14,-4.79,;-2.81,-5.56,;-1.48,-4.79,;-.01,-5.27,;.89,-4.02,;-.01,-2.77,;-1.48,-3.25,;-2.81,-2.48,)|

BDBM198607

FC(F)(F)C(N[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)C(F)(F)F |r,wU:9.12,wD:6.5,(3.4,5.56,;3.8,4.07,;5.29,3.67,;4.89,5.16,;2.71,2.98,;1.22,3.38,;.14,2.29,;-1.35,2.69,;-2.44,1.6,;-2.04,.12,;-.55,-.28,;.53,.81,;-3.13,-.97,;-4.66,-.81,;-5.29,-2.22,;-4.14,-3.25,;-4.14,-4.79,;-2.81,-5.56,;-1.48,-4.79,;-.01,-5.27,;.89,-4.02,;-.01,-2.77,;-1.48,-3.25,;-2.81,-2.48,;3.11,1.5,;2.02,.41,;4.6,1.1,;3.51,.01,)|

BDBM198608

OC[C@H]1CC[C@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:5.8,2.1,(4,4.07,;2.51,4.47,;1.42,3.38,;1.82,1.89,;.73,.81,;-.75,1.2,;-1.15,2.69,;-.06,3.78,;-1.84,.12,;-3.37,.28,;-4,-1.13,;-2.86,-2.16,;-2.86,-3.7,;-1.52,-4.47,;-.19,-3.7,;1.28,-4.18,;2.18,-2.93,;1.28,-1.69,;-.19,-2.16,;-1.52,-1.39,)|

BDBM198609

O=C[C@H]1CC[C@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:5.8,2.1,(4,4.07,;2.51,4.47,;1.42,3.38,;1.82,1.89,;.73,.81,;-.75,1.2,;-1.15,2.69,;-.06,3.78,;-1.84,.12,;-3.37,.28,;-4,-1.13,;-2.86,-2.16,;-2.86,-3.7,;-1.52,-4.47,;-.19,-3.7,;1.28,-4.18,;2.18,-2.93,;1.28,-1.69,;-.19,-2.16,;-1.52,-1.39,)|

BDBM198610

OC1CN(C[C@H]2CC[C@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:8.11,5.4,(5.8,2.92,;4.31,3.32,;2.98,2.55,;2.21,3.89,;.72,4.29,;-.37,3.2,;.03,1.71,;-1.06,.62,;-2.55,1.02,;-2.95,2.51,;-1.86,3.6,;-3.64,-.07,;-5.17,.09,;-5.8,-1.32,;-4.65,-2.35,;-4.65,-3.89,;-3.32,-4.66,;-1.98,-3.89,;-.52,-4.36,;.39,-3.12,;-.52,-1.87,;-1.98,-2.35,;-3.32,-1.58,;3.54,4.66,)|

BDBM198611

O[C@H]1CCN(C[C@H]2CC[C@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:9.12,6.5,1.0,(5.85,5.04,;4.52,4.27,;4.52,2.73,;3.05,2.26,;2.15,3.5,;.66,3.9,;-.43,2.81,;-.03,1.32,;-1.12,.24,;-2.61,.63,;-3,2.12,;-1.92,3.21,;-3.69,-.46,;-5.23,-.29,;-5.85,-1.7,;-4.71,-2.73,;-4.71,-4.27,;-3.37,-5.04,;-2.04,-4.27,;-.58,-4.75,;.33,-3.5,;-.58,-2.26,;-2.04,-2.73,;-3.37,-1.96,;3.05,4.75,)|

BDBM198612

O[C@@H]1CCN(C[C@H]2CC[C@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:9.12,6.5,wD:1.0,(5.85,5.04,;4.52,4.27,;4.52,2.73,;3.05,2.26,;2.15,3.5,;.66,3.9,;-.43,2.81,;-.03,1.32,;-1.12,.24,;-2.61,.63,;-3,2.12,;-1.92,3.21,;-3.69,-.46,;-5.23,-.29,;-5.85,-1.7,;-4.71,-2.73,;-4.71,-4.27,;-3.37,-5.04,;-2.04,-4.27,;-.58,-4.75,;.33,-3.5,;-.58,-2.26,;-2.04,-2.73,;-3.37,-1.96,;3.05,4.75,)|

BDBM198613

C(NC1CC1)[C@H]1CC[C@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:8.12,5.5,(1.22,3.38,;2.71,2.98,;3.8,4.07,;5.29,4.47,;4.2,5.56,;.14,2.29,;.53,.81,;-.55,-.28,;-2.04,.12,;-2.44,1.6,;-1.35,2.69,;-3.13,-.97,;-4.66,-.81,;-5.29,-2.22,;-4.14,-3.25,;-4.14,-4.79,;-2.81,-5.56,;-1.48,-4.79,;-.01,-5.27,;.89,-4.02,;-.01,-2.77,;-1.48,-3.25,;-2.81,-2.48,)|

BDBM198614

FC(F)(F)CN(C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)C(=O)CC#N |r,wU:10.13,wD:7.6,(4.94,2.58,;4.55,4.07,;5.63,5.16,;6.03,3.67,;3.06,4.47,;1.97,3.38,;.48,3.78,;-.61,2.69,;-2.1,3.09,;-3.18,2,;-2.79,.51,;-1.3,.12,;-.21,1.2,;-3.87,-.58,;-5.41,-.41,;-6.03,-1.82,;-4.89,-2.85,;-4.89,-4.39,;-3.55,-5.16,;-2.22,-4.39,;-.76,-4.87,;.15,-3.62,;-.76,-2.38,;-2.22,-2.85,;-3.55,-2.08,;2.37,1.89,;1.28,.81,;3.85,1.5,;4.25,.01,;4.65,-1.48,)|

BDBM198615

O=C(CC#N)N(CC#N)C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:13.16,wD:10.9,(1.28,1.15,;2.37,2.24,;3.85,1.84,;4.25,.35,;4.65,-1.13,;1.97,3.73,;3.06,4.82,;4.55,4.42,;6.03,4.02,;.48,4.13,;-.61,3.04,;-2.1,3.44,;-3.18,2.35,;-2.79,.86,;-1.3,.46,;-.21,1.55,;-3.87,-.23,;-5.41,-.07,;-6.03,-1.48,;-4.89,-2.51,;-4.89,-4.05,;-3.55,-4.82,;-2.22,-4.05,;-.76,-4.52,;.15,-3.28,;-.76,-2.03,;-2.22,-2.51,;-3.55,-1.74,)|

BDBM198616

O=C(CC#N)N(C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)C1CC1 |r,wU:10.13,wD:7.6,(1.97,.41,;3.06,1.5,;4.55,1.1,;4.94,-.39,;5.34,-1.88,;2.66,2.98,;1.17,3.38,;.08,2.29,;-1.41,2.69,;-2.49,1.6,;-2.1,.12,;-.61,-.28,;.48,.81,;-3.18,-.97,;-4.72,-.81,;-5.34,-2.22,;-4.2,-3.25,;-4.2,-4.79,;-2.86,-5.56,;-1.53,-4.79,;-.07,-5.27,;.84,-4.02,;-.07,-2.77,;-1.53,-3.25,;-2.86,-2.48,;3.75,4.07,;5.24,4.47,;4.15,5.56,)|

BDBM198617

Cc1ccc(CN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C(=O)CC#N)o1 |r,wU:11.14,wD:8.7,(7.14,5.39,;5.81,4.62,;5.81,3.08,;4.34,2.6,;3.44,3.85,;1.95,4.25,;.86,3.16,;-.63,3.56,;-1.72,2.47,;-3.2,2.86,;-4.29,1.78,;-3.89,.29,;-2.41,-.11,;-1.32,.98,;-4.98,-.8,;-6.51,-.64,;-7.14,-2.05,;-6,-3.08,;-6,-4.62,;-4.66,-5.39,;-3.33,-4.62,;-1.86,-5.09,;-.96,-3.85,;-1.86,-2.6,;-3.33,-3.08,;-4.66,-2.31,;1.26,1.67,;.17,.58,;2.75,1.27,;3.15,-.22,;3.54,-1.7,;4.34,5.09,)|

BDBM198618

FC(F)(F)CN(C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)C(=O)CC(F)(F)F |r,wU:10.13,wD:7.6,(4.94,2.58,;4.55,4.07,;5.63,5.16,;6.03,3.67,;3.06,4.47,;1.97,3.38,;.48,3.78,;-.61,2.69,;-2.1,3.09,;-3.18,2,;-2.79,.51,;-1.3,.12,;-.21,1.2,;-3.87,-.58,;-5.41,-.41,;-6.03,-1.82,;-4.89,-2.85,;-4.89,-4.39,;-3.55,-5.16,;-2.22,-4.39,;-.76,-4.87,;.15,-3.62,;-.76,-2.38,;-2.22,-2.85,;-3.55,-2.08,;2.37,1.89,;1.28,.81,;3.85,1.5,;4.25,.01,;5.74,-.39,;3.16,-1.08,;4.65,-1.48,)|

BDBM198619

FC(F)(F)CC(=O)N(CC#N)C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:15.18,wD:12.11,(5.74,-.04,;4.25,.35,;3.16,-.74,;4.65,-1.13,;3.85,1.84,;2.37,2.24,;1.28,1.15,;1.97,3.73,;3.06,4.82,;4.55,4.42,;6.03,4.02,;.48,4.13,;-.61,3.04,;-2.1,3.44,;-3.18,2.35,;-2.79,.86,;-1.3,.46,;-.21,1.55,;-3.87,-.23,;-5.41,-.07,;-6.03,-1.48,;-4.89,-2.51,;-4.89,-4.05,;-3.55,-4.82,;-2.22,-4.05,;-.76,-4.52,;.15,-3.28,;-.76,-2.03,;-2.22,-2.51,;-3.55,-1.74,)|

BDBM198620

FC(F)(F)CN(CC1CC1)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:13.17,wD:10.10,(4.94,.15,;3.46,.55,;2.37,-.54,;3.85,-.93,;3.06,2.04,;1.57,2.44,;1.17,3.93,;2.26,5.02,;3.75,5.41,;2.66,6.5,;.48,1.35,;-1.01,1.75,;-2.1,.66,;-1.7,-.83,;-.21,-1.23,;.88,-.14,;-2.79,-1.92,;-4.32,-1.76,;-4.94,-3.16,;-3.8,-4.19,;-3.8,-5.73,;-2.47,-6.5,;-1.13,-5.73,;.33,-6.21,;1.24,-4.96,;.33,-3.72,;-1.13,-4.19,;-2.47,-3.42,)|

BDBM198621

N#CCN(CC1CC1)C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:12.16,wD:9.9,(6.03,4.02,;4.55,4.42,;3.06,4.82,;1.97,3.73,;2.37,2.24,;3.85,1.84,;4.94,.75,;5.34,2.24,;.48,4.13,;-.61,3.04,;-2.1,3.44,;-3.18,2.35,;-2.79,.86,;-1.3,.46,;-.21,1.55,;-3.87,-.23,;-5.41,-.07,;-6.03,-1.48,;-4.89,-2.51,;-4.89,-4.05,;-3.55,-4.82,;-2.22,-4.05,;-.76,-4.52,;.15,-3.28,;-.76,-2.03,;-2.22,-2.51,;-3.55,-1.74,)|

BDBM198622

FC(F)(F)CN(CC1CC1)C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:14.18,wD:11.11,(4.94,2.58,;4.55,4.07,;5.63,5.16,;6.03,3.67,;3.06,4.47,;1.97,3.38,;2.37,1.89,;1.28,.81,;-.21,.41,;.88,-.68,;.48,3.78,;-.61,2.69,;-2.1,3.09,;-3.18,2,;-2.79,.51,;-1.3,.12,;-.21,1.2,;-3.87,-.58,;-5.41,-.41,;-6.03,-1.82,;-4.89,-2.85,;-4.89,-4.39,;-3.55,-5.16,;-2.22,-4.39,;-.76,-4.87,;.15,-3.62,;-.76,-2.38,;-2.22,-2.85,;-3.55,-2.08,)|

BDBM198623

OS(=O)(=O)C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:8.11,wD:5.4,(4.42,4.82,;3.33,3.73,;2.94,2.24,;4.67,2.96,;1.85,4.13,;.76,3.04,;-.73,3.44,;-1.82,2.35,;-1.42,.86,;.07,.46,;1.16,1.55,;-2.51,-.23,;-4.04,-.07,;-4.67,-1.48,;-3.52,-2.51,;-3.52,-4.05,;-2.19,-4.82,;-.86,-4.05,;.61,-4.52,;1.51,-3.28,;.61,-2.03,;-.86,-2.51,;-2.19,-1.74,)|

BDBM198624

O=S(=O)(C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)NC1CC1 |r,wU:7.10,wD:4.3,(1.57,2.24,;1.97,3.73,;3.3,2.96,;.48,4.13,;-.61,3.04,;-2.1,3.44,;-3.18,2.35,;-2.79,.86,;-1.3,.46,;-.21,1.55,;-3.87,-.23,;-5.41,-.07,;-6.03,-1.48,;-4.89,-2.51,;-4.89,-4.05,;-3.55,-4.82,;-2.22,-4.05,;-.76,-4.52,;.15,-3.28,;-.76,-2.03,;-2.22,-2.51,;-3.55,-1.74,;3.06,4.82,;4.55,4.42,;5.63,3.33,;6.03,4.82,)|

BDBM198625

CN(C)S(=O)(=O)C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:10.13,wD:7.6,(5.29,3.67,;3.8,4.07,;3.4,5.56,;2.71,2.98,;2.31,1.5,;4.05,2.21,;1.22,3.38,;.14,2.29,;-1.35,2.69,;-2.44,1.6,;-2.04,.12,;-.55,-.28,;.53,.81,;-3.13,-.97,;-4.66,-.81,;-5.29,-2.22,;-4.14,-3.25,;-4.14,-4.79,;-2.81,-5.56,;-1.48,-4.79,;-.01,-5.27,;.89,-4.02,;-.01,-2.77,;-1.48,-3.25,;-2.81,-2.48,)|

BDBM198626

O=S(=O)(C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)NCC#N |r,wU:7.10,wD:4.3,(1.22,1.35,;1.62,2.84,;2.96,2.07,;.14,3.24,;-.95,2.15,;-2.44,2.55,;-3.53,1.46,;-3.13,-.03,;-1.64,-.43,;-.55,.66,;-4.22,-1.12,;-5.75,-.96,;-6.38,-2.37,;-5.23,-3.4,;-5.23,-4.94,;-3.9,-5.71,;-2.57,-4.94,;-1.1,-5.41,;-.2,-4.17,;-1.1,-2.92,;-2.57,-3.4,;-3.9,-2.63,;2.71,3.93,;4.2,3.53,;5.29,4.62,;6.38,5.71,)|

BDBM198627

FC(F)(F)CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:13.16,wD:10.9,(6.58,4.02,;5.09,4.42,;4.69,5.91,;6.18,5.51,;4,3.33,;2.51,3.73,;1.42,2.64,;1.03,1.15,;2.76,1.87,;-.06,3.04,;-1.15,1.95,;-2.64,2.35,;-3.73,1.26,;-3.33,-.23,;-1.84,-.63,;-.75,.46,;-4.42,-1.32,;-5.95,-1.16,;-6.58,-2.56,;-5.43,-3.6,;-5.43,-5.14,;-4.1,-5.91,;-2.77,-5.14,;-1.3,-5.61,;-.4,-4.37,;-1.3,-3.12,;-2.77,-3.6,;-4.1,-2.83,)|

BDBM198628

FC(F)(F)COC1CN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:13.16,wD:10.9,(6.39,-.45,;6,1.04,;7.08,2.13,;7.48,.64,;4.51,1.44,;4.11,2.92,;2.62,3.32,;1.29,2.55,;.52,3.89,;-.97,4.29,;-2.06,3.2,;-3.55,3.6,;-4.63,2.51,;-4.24,1.02,;-2.75,.62,;-1.66,1.71,;-5.33,-.07,;-6.86,.09,;-7.48,-1.32,;-6.34,-2.35,;-6.34,-3.89,;-5,-4.66,;-3.67,-3.89,;-2.21,-4.36,;-1.3,-3.12,;-2.21,-1.87,;-3.67,-2.35,;-5,-1.58,;1.85,4.66,)|

BDBM198629

CC1(O)CN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:9.12,wD:6.5,(5.72,4.09,;4.39,3.32,;5.16,1.99,;3.05,2.55,;2.28,3.89,;.79,4.29,;-.29,3.2,;-1.78,3.6,;-2.87,2.51,;-2.47,1.02,;-.98,.62,;.1,1.71,;-3.56,-.07,;-5.09,.09,;-5.72,-1.32,;-4.57,-2.35,;-4.57,-3.89,;-3.24,-4.66,;-1.91,-3.89,;-.44,-4.36,;.46,-3.12,;-.44,-1.87,;-1.91,-2.35,;-3.24,-1.58,;3.62,4.66,)|

BDBM198630

CN(C)C1CN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:10.13,wD:7.6,(6.34,4.01,;5.25,2.92,;5.65,1.44,;3.76,3.32,;2.43,2.55,;1.66,3.89,;.17,4.29,;-.92,3.2,;-2.4,3.6,;-3.49,2.51,;-3.09,1.02,;-1.61,.62,;-.52,1.71,;-4.18,-.07,;-5.71,.09,;-6.34,-1.32,;-5.2,-2.35,;-5.2,-3.89,;-3.86,-4.66,;-2.53,-3.89,;-1.06,-4.36,;-.16,-3.12,;-1.06,-1.87,;-2.53,-2.35,;-3.86,-1.58,;2.99,4.66,)|

BDBM198631

CCN(C)C1CN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:11.14,wD:8.7,(7.08,3.61,;5.6,4.01,;4.51,2.92,;4.91,1.44,;3.02,3.32,;1.69,2.55,;.92,3.89,;-.57,4.29,;-1.66,3.2,;-3.15,3.6,;-4.24,2.51,;-3.84,1.02,;-2.35,.62,;-1.26,1.71,;-4.93,-.07,;-6.46,.09,;-7.08,-1.32,;-5.94,-2.35,;-5.94,-3.89,;-4.61,-4.66,;-3.27,-3.89,;-1.81,-4.36,;-.9,-3.12,;-1.81,-1.87,;-3.27,-2.35,;-4.61,-1.58,;2.25,4.66,)|

BDBM198632

OC1(CN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1)C(F)(F)F |r,wU:8.11,wD:5.4,(4.49,1.5,;3.72,2.83,;2.39,2.06,;1.62,3.4,;.13,3.8,;-.96,2.71,;-2.45,3.11,;-3.54,2.02,;-3.14,.53,;-1.65,.13,;-.56,1.22,;-4.23,-.56,;-5.76,-.4,;-6.39,-1.8,;-5.24,-2.83,;-5.24,-4.37,;-3.91,-5.14,;-2.57,-4.37,;-1.11,-4.85,;-.2,-3.6,;-1.11,-2.36,;-2.57,-2.83,;-3.91,-2.06,;2.95,4.17,;5.05,3.6,;6.39,2.83,;5.05,5.14,;6.39,4.37,)|

BDBM198633

FC(F)(F)CNC(=O)C1CN(C[C@H]2CC[C@@H](CC2)c2nnn3cnc4[nH]ccc4c23)C1 |r,wU:15.18,wD:12.11,(8.37,3.54,;6.89,3.94,;6.49,5.42,;7.97,5.03,;5.8,2.85,;4.31,3.25,;3.22,2.16,;3.62,.67,;1.73,2.56,;.4,1.79,;-.37,3.12,;-1.86,3.52,;-2.95,2.43,;-4.44,2.83,;-5.52,1.74,;-5.13,.25,;-3.64,-.15,;-2.55,.94,;-6.21,-.84,;-7.75,-.68,;-8.37,-2.08,;-7.23,-3.11,;-7.23,-4.65,;-5.89,-5.42,;-4.56,-4.65,;-3.1,-5.13,;-2.19,-3.88,;-3.1,-2.64,;-4.56,-3.11,;-5.89,-2.34,;.96,3.89,)|

BDBM198634

CS(=O)(=O)NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:9.12,wD:6.5,(5.29,3.67,;3.8,4.07,;4.2,5.56,;2.71,5.16,;2.71,2.98,;1.22,3.38,;.14,2.29,;-1.35,2.69,;-2.44,1.6,;-2.04,.12,;-.55,-.28,;.53,.81,;-3.13,-.97,;-4.66,-.81,;-5.29,-2.22,;-4.14,-3.25,;-4.14,-4.79,;-2.81,-5.56,;-1.48,-4.79,;-.01,-5.27,;.89,-4.02,;-.01,-2.77,;-1.48,-3.25,;-2.81,-2.48,)|

BDBM198635

CC(C)(C)OC(=O)N1CC(CC#N)(C1)NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:19.23,wD:16.16,(7.97,3.8,;6.89,2.71,;7.28,1.22,;8.37,2.31,;5.4,3.11,;4.31,2.02,;4.71,.53,;2.82,2.42,;1.49,1.65,;.72,2.98,;.32,4.47,;1.41,5.56,;2.5,6.65,;2.05,3.75,;-.37,1.89,;-1.86,2.29,;-2.95,1.2,;-4.44,1.6,;-5.52,.51,;-5.13,-.97,;-3.64,-1.37,;-2.55,-.28,;-6.21,-2.06,;-7.75,-1.9,;-8.37,-3.31,;-7.23,-4.34,;-7.23,-5.88,;-5.89,-6.65,;-4.56,-5.88,;-3.1,-6.35,;-2.19,-5.11,;-3.1,-3.86,;-4.56,-4.34,;-5.89,-3.57,)|

BDBM198636

ON=C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,w:1.0,wU:6.9,wD:3.2,(4.55,4.82,;3.46,3.73,;1.97,4.13,;.88,3.04,;-.61,3.44,;-1.7,2.35,;-1.3,.86,;.19,.46,;1.28,1.55,;-2.39,-.23,;-3.92,-.07,;-4.55,-1.48,;-3.4,-2.51,;-3.4,-4.05,;-2.07,-4.82,;-.73,-4.05,;.73,-4.52,;1.64,-3.28,;.73,-2.03,;-.73,-2.51,;-2.07,-1.74,)|

BDBM198637

N#C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:5.8,wD:2.1,(3.8,5.02,;2.71,3.93,;1.62,2.84,;.14,3.24,;-.95,2.15,;-.55,.66,;.93,.26,;2.02,1.35,;-1.64,-.43,;-3.18,-.27,;-3.8,-1.68,;-2.66,-2.71,;-2.66,-4.25,;-1.32,-5.02,;.01,-4.25,;1.48,-4.72,;2.38,-3.48,;1.48,-2.23,;.01,-2.71,;-1.32,-1.94,)|

BDBM198638

N#CC(=C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)C#N |r,wU:7.10,wD:4.3,(5.09,5.36,;4,4.27,;2.91,3.18,;1.42,3.58,;.34,2.49,;-1.15,2.89,;-2.24,1.8,;-1.84,.31,;-.36,-.08,;.73,1.01,;-2.93,-.77,;-4.46,-.61,;-5.09,-2.02,;-3.95,-3.05,;-3.95,-4.59,;-2.61,-5.36,;-1.28,-4.59,;.19,-5.07,;1.09,-3.82,;.19,-2.57,;-1.28,-3.05,;-2.61,-2.28,;3.31,1.7,;3.71,.21,)|

BDBM198639

N#CC(C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)C#N |r,wU:7.10,wD:4.3,(5.09,5.36,;4,4.27,;2.91,3.18,;1.42,3.58,;.34,2.49,;-1.15,2.89,;-2.24,1.8,;-1.84,.31,;-.36,-.08,;.73,1.01,;-2.93,-.77,;-4.46,-.61,;-5.09,-2.02,;-3.95,-3.05,;-3.95,-4.59,;-2.61,-5.36,;-1.28,-4.59,;.19,-5.07,;1.09,-3.82,;.19,-2.57,;-1.28,-3.05,;-2.61,-2.28,;3.31,1.7,;3.71,.21,)|

BDBM198640

C=C1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198641

N#CC=C1CCC(CC1)c1nnn2cnc3[nH]ccc3c12 |(4.74,3.67,;3.26,4.07,;1.77,4.47,;.68,3.38,;1.08,1.89,;-.01,.81,;-1.5,1.2,;-1.9,2.69,;-.81,3.78,;-2.59,.12,;-4.12,.28,;-4.74,-1.13,;-3.6,-2.16,;-3.6,-3.7,;-2.27,-4.47,;-.93,-3.7,;.53,-4.18,;1.44,-2.93,;.53,-1.69,;-.93,-2.16,;-2.27,-1.39,)|

BDBM198642

N#CC[C@H]1CC[C@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:6.9,3.2,(4.74,3.67,;3.26,4.07,;1.77,4.47,;.68,3.38,;1.08,1.89,;-.01,.81,;-1.5,1.2,;-1.9,2.69,;-.81,3.78,;-2.59,.12,;-4.12,.28,;-4.74,-1.13,;-3.6,-2.16,;-3.6,-3.7,;-2.27,-4.47,;-.93,-3.7,;.53,-4.18,;1.44,-2.93,;.53,-1.69,;-.93,-2.16,;-2.27,-1.39,)|

BDBM198643

N#CC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:6.9,wD:3.2,(4.74,3.67,;3.26,4.07,;1.77,4.47,;.68,3.38,;-.81,3.78,;-1.9,2.69,;-1.5,1.2,;-.01,.81,;1.08,1.89,;-2.59,.12,;-4.12,.28,;-4.74,-1.13,;-3.6,-2.16,;-3.6,-3.7,;-2.27,-4.47,;-.93,-3.7,;.53,-4.18,;1.44,-2.93,;.53,-1.69,;-.93,-2.16,;-2.27,-1.39,)|

BDBM198644

CCOC(=O)C=C1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198645

CC(C#N)=C1CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM198646

CCOC(=O)CC1CCC(CC1)c1nnn2cnc3[nH]ccc3c12 |(5.83,5.16,;4.74,4.07,;3.26,4.47,;2.17,3.38,;2.57,1.89,;.68,3.78,;-.41,2.69,;-.01,1.2,;-1.1,.12,;-2.59,.51,;-2.98,2,;-1.9,3.09,;-3.68,-.58,;-5.21,-.41,;-5.83,-1.82,;-4.69,-2.85,;-4.69,-4.39,;-3.36,-5.16,;-2.02,-4.39,;-.56,-4.87,;.35,-3.62,;-.56,-2.38,;-2.02,-2.85,;-3.36,-2.08,)|

BDBM198647

CC(C#N)[C@H]1CC[C@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:7.10,4.3,(1.37,5.21,;1.77,3.73,;3.26,3.33,;4.74,2.93,;.68,2.64,;1.08,1.15,;-.01,.06,;-1.5,.46,;-1.9,1.95,;-.81,3.04,;-2.59,-.63,;-4.12,-.47,;-4.74,-1.87,;-3.6,-2.9,;-3.6,-4.44,;-2.27,-5.21,;-.93,-4.44,;.53,-4.92,;1.44,-3.67,;.53,-2.43,;-.93,-2.9,;-2.27,-2.13,)|

BDBM198648

CC(C#N)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:7.10,wD:4.3,(1.37,5.21,;1.77,3.73,;3.26,3.33,;4.74,2.93,;.68,2.64,;-.81,3.04,;-1.9,1.95,;-1.5,.46,;-.01,.06,;1.08,1.15,;-2.59,-.63,;-4.12,-.47,;-4.74,-1.87,;-3.6,-2.9,;-3.6,-4.44,;-2.27,-5.21,;-.93,-4.44,;.53,-4.92,;1.44,-3.67,;.53,-2.43,;-.93,-2.9,;-2.27,-2.13,)|

BDBM198649

N#C\C=C\[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:7.10,wD:4.3,(5.09,5.36,;4,4.27,;2.91,3.18,;1.42,3.58,;.34,2.49,;-1.15,2.89,;-2.24,1.8,;-1.84,.31,;-.36,-.08,;.73,1.01,;-2.93,-.77,;-4.46,-.61,;-5.09,-2.02,;-3.95,-3.05,;-3.95,-4.59,;-2.61,-5.36,;-1.28,-4.59,;.19,-5.07,;1.09,-3.82,;.19,-2.57,;-1.28,-3.05,;-2.61,-2.28,)|

BDBM198650

N#CCC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:7.10,wD:4.3,(5.09,5.36,;4,4.27,;2.91,3.18,;1.42,3.58,;.34,2.49,;-1.15,2.89,;-2.24,1.8,;-1.84,.31,;-.36,-.08,;.73,1.01,;-2.93,-.77,;-4.46,-.61,;-5.09,-2.02,;-3.95,-3.05,;-3.95,-4.59,;-2.61,-5.36,;-1.28,-4.59,;.19,-5.07,;1.09,-3.82,;.19,-2.57,;-1.28,-3.05,;-2.61,-2.28,)|

BDBM198651

FC(F)(F)CNC(=O)C[C@H]1CC[C@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:12.15,9.8,(6.58,4.02,;5.09,4.42,;4.69,5.91,;6.18,5.51,;4,3.33,;2.51,3.73,;1.42,2.64,;1.82,1.15,;-.06,3.04,;-1.15,1.95,;-.75,.46,;-1.84,-.63,;-3.33,-.23,;-3.73,1.26,;-2.64,2.35,;-4.42,-1.32,;-5.95,-1.16,;-6.58,-2.56,;-5.43,-3.6,;-5.43,-5.14,;-4.1,-5.91,;-2.77,-5.14,;-1.3,-5.61,;-.4,-4.37,;-1.3,-3.12,;-2.77,-3.6,;-4.1,-2.83,)|

BDBM198652

FC(F)(F)CNC(=O)C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:12.15,wD:9.8,(6.58,4.02,;5.09,4.42,;4.69,5.91,;6.18,5.51,;4,3.33,;2.51,3.73,;1.42,2.64,;1.82,1.15,;-.06,3.04,;-1.15,1.95,;-2.64,2.35,;-3.73,1.26,;-3.33,-.23,;-1.84,-.63,;-.75,.46,;-4.42,-1.32,;-5.95,-1.16,;-6.58,-2.56,;-5.43,-3.6,;-5.43,-5.14,;-4.1,-5.91,;-2.77,-5.14,;-1.3,-5.61,;-.4,-4.37,;-1.3,-3.12,;-2.77,-3.6,;-4.1,-2.83,)|

BDBM198653

O=C(C[C@H]1CC[C@H](CC1)c1nnn2cnc3[nH]ccc3c12)NCC#N |r,wU:6.9,3.2,(2.02,1.35,;1.62,2.84,;.14,3.24,;-.95,2.15,;-.55,.66,;-1.64,-.43,;-3.13,-.03,;-3.53,1.46,;-2.44,2.55,;-4.22,-1.12,;-5.75,-.96,;-6.38,-2.37,;-5.23,-3.4,;-5.23,-4.94,;-3.9,-5.71,;-2.57,-4.94,;-1.1,-5.41,;-.2,-4.17,;-1.1,-2.92,;-2.57,-3.4,;-3.9,-2.63,;2.71,3.93,;4.2,3.53,;5.29,4.62,;6.38,5.71,)|

BDBM198654

O=C(C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)NCC#N |r,wU:6.9,wD:3.2,(2.02,1.35,;1.62,2.84,;.14,3.24,;-.95,2.15,;-2.44,2.55,;-3.53,1.46,;-3.13,-.03,;-1.64,-.43,;-.55,.66,;-4.22,-1.12,;-5.75,-.96,;-6.38,-2.37,;-5.23,-3.4,;-5.23,-4.94,;-3.9,-5.71,;-2.57,-4.94,;-1.1,-5.41,;-.2,-4.17,;-1.1,-2.92,;-2.57,-3.4,;-3.9,-2.63,;2.71,3.93,;4.2,3.53,;5.29,4.62,;6.38,5.71,)|

BDBM198655

N#CC1CC11CCC(CC1)c1nnn2cnc3[nH]ccc3c12 |(4.94,2.78,;3.46,3.18,;1.97,3.58,;.88,4.67,;.48,3.18,;.88,1.7,;-.21,.61,;-1.7,1.01,;-2.1,2.49,;-1.01,3.58,;-2.79,-.08,;-4.32,.08,;-4.94,-1.33,;-3.8,-2.36,;-3.8,-3.9,;-2.47,-4.67,;-1.13,-3.9,;.33,-4.38,;1.24,-3.13,;.33,-1.88,;-1.13,-2.36,;-2.47,-1.59,)|

BDBM198656

OC12CC3CC(C1)CC(C3)(C2)c1nnn2cnc3[nH]ccc3c12 |TLB:11:8:4:2.1.6,THB:7:8:2:4.5.6,7:5:2:8.10.9,10:8:4:2.1.6,10:1:4:8.7.9|

BDBM202552

CN(C)C(=O)\C=C\c1ccc(o1)-c1nc2cnc3[nH]ccc3c2n1C1CCCCC1

BDBM202553

CN(C)C(=O)C(=C\c1ccc(o1)-c1nc2cnc3[nH]ccc3c2n1C1CCCCC1)\C#N

BDBM202554

C[C@@H]1CCCC[C@@H]1n1c(nc2cnc3[nH]ccc3c12)-c1ccc(\C=C(/C#N)C(=O)N(C)C)o1 |r|

BDBM209866

C[C@H]1CC[C@H](CN1C(=O)C=C)Nc1ncnc2[nH]ccc12 |r|

BDBM709264

Cc3cnc(Nc2ccc1CN(C)Cc1c2)nc3N6CC(CC#N)(N4CCC5(CC4)CC5(F)F)C6

BDBM709265

Cc3cnc(Nc2ccc1CN(C)Cc1c2)nc3N6CC(CC#N)(N4CCCC5(C4)CC5(F)F)C6

BDBM709266

Cc3cnc(Nc2ccc1CN(C)Cc1c2)nc3N6CC(CC#N)(N4CCC5(CC4)CC5)C6

BDBM709267

Cc3cnc(Nc2ccc(N1CCN(C)CC1)c(C(F)(F)F)c2)nc3N4CC5(C4)CC5(F)F

BDBM709268

Cc2cnc(Nc1cccc(CN(C)C)c1)nc2N5CC(CC#N)(N3CCCC4(C3)CC4(F)F)C5

BDBM709269

Cc2cnc(Nc1cccnc1)nc2N4CC(CC#N)(N3CCN(C)CC3)C4

BDBM709270

Cc3cnc(Nc2ccc(N1CCOCC1)cc2)nc3N5CC(CC#N)(N4CCN(C)CC4)C5

BDBM709271

Cc3cnc(Nc2ccc(N1CCOCC1)c(F)c2)nc3N5CC(CC#N)(N4CCCCC4)C5

BDBM709272

Cc3cnc(Nc2ccc1CN(C)Cc1c2)nc3N5CC(CC#N)(N4CCC(F)(F)CC4)C5

BDBM277390

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCC#N)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277391

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCF)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277392

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)c3cccnc3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277393

CN(C)CC(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:4:6:10.9.8:13.12.14|

BDBM277574

Cc5cc(Nc4cc1ncccc1c(N[C@@H]2C[C@H]3CC[C@@H](C2)N3C(=O)C(F)F)n4)n[nH]5

BDBM277395

COCCS(=O)(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:4:7:10.9:13.12.14|

BDBM277396

CCS(=O)(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:2:5:8.7:11.10.12|

BDBM277397

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)c3cccnc3)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277398

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)c3ccccc3)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277399

CCS(=O)(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:2:5:12.11.13:7.9.8|

BDBM277400

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)N3CC(C3)C#N)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277401

CC(C)COC(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2nc(CO)ccc12 |r,TLB:5:7:10.9:13.12.14|

BDBM277402

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)N3CC(C3)C#N)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277403

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)c3cncc(F)c3)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277404

Cc1cc(Nc2cc3nc(CN4CCOCC4)ccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC(F)(F)F)n2)n[nH]1 |r,TLB:30:29:26.25:22.28.23|

BDBM277405

COC(=O)c1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4C3CCCOC3=O)c2c1 |r,TLB:28:27:24.23:20.26.21|

BDBM277406

CNC(=O)CN1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:4:5:9.8.7:12.11.13|

BDBM757743

COC(=O)N1[C@@H]2CC[C@H]1C[C@H](Nc1nc(Nc3cc(C)[nH]n3)cc3ncccc13)C2

BDBM277407

COC(=O)CN1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:4:5:8.7:11.10.12|

BDBM277409

COC(=O)CCCN1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:6:7:10.9:13.12.14|

BDBM277410

CC(C)OC(=O)CN1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:6:7:10.9:13.12.14|

BDBM277411

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC(=O)OC(C)(C)C)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277412

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC(N)=O)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277413

CNC(=O)CN1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:4:5:8.7:11.10.12|

BDBM277414

CN(C)C(=O)CN1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:5:6:9.8:12.11.13|

BDBM277415

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCCF)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277416

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCC(F)(F)F)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277417

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC(=O)N[C@@H]3CCOC3=O)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277418

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC(=O)N[C@H]3CCOC3=O)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277419

CC(C)CN1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:3:4:7.6:10.9.11|

BDBM277420

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC(F)(F)F)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277421

COCCCN1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:4:5:8.7:11.10.12|

BDBM277422

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4Cc3cccnc3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277423

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4Cc3ccncc3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277424

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4Cc3ccc(O)cc3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277425

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4Cc3cccc(O)c3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277426

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC3CCOCC3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277427

CC(CC#N)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:1:5:8.7:11.10.12|

BDBM277428

CCC(CC#N)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:2:6:9.8:12.11.13|

BDBM277429

CC(CN1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12)C#N |r,TLB:2:3:6.5:9.8.10|

BDBM277430

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC3(CC3)C#N)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277431

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4C3(CC#N)COC3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277433

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4[C@@H]3CCOC3=O)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277432

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4[C@H]3CCOC3=O)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277434

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4C3CCCOC3=O)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM487189

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4C[C@H]3CCC(=O)O3)n2)n[nH]1 |r,TLB:23:22:19.18:16.15.21|

BDBM277436

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC3COC(=O)O3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277437

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CCC#N)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277438

COC(=O)CN1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:4:5:12.11.13:7.9.8|

BDBM277439

COC(=O)CCN1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:5:6:13.12.14:8.10.9|

BDBM277440

COC(=O)CCCN1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:6:7:14.13.15:9.11.10|

BDBM277441

CC(C)OC(=O)CN1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:6:7:14.13.15:9.11.10|

BDBM277442

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CC(=O)OC(C)(C)C)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277443

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CC(N)=O)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277444

CN(C)C(=O)CN1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:5:6:13.12.14:8.10.9|

BDBM277445

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CCF)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277446

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CCCF)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277447

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CC(=O)N[C@@H]3CCOC3=O)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277448

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CC(=O)N[C@H]3CCOC3=O)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277449

CC(C)CN1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:3:4:11.10.12:6.8.7|

BDBM277450

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CCC(F)(F)F)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277451

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CC(F)(F)F)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277452

COCCCN1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:4:5:12.11.13:7.9.8|

BDBM277453

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4Cc3cccnc3)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277454

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4Cc3ccncc3)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277455

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4Cc3cccc(O)c3)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277456

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4Cc3ccc(O)cc3)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277458

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4[C@@H]3CCOC3=O)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277457

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4[C@H]3CCOC3=O)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277459

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C3CCCOC3=O)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM487214

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4Cc3cncc(c3)C#N)n2)n[nH]1 |THB:24:23:18.19.20:15.16.22|

BDBM277461

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4Cc3ccnc(c3)C#N)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277462

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4Cc3ccncc3C#N)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277463

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C[C@H]3CCC(=O)O3)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277464

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CC3COC(=O)O3)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277465

CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:2:4:7.6:10.9.11|

BDBM757802

Cc1cc(Nc2cc3ncccc3c(N[C@@H]3C[C@H]4CC[C@@H](C3)N4C(=O)CCF)n2)n[nH]1

BDBM277467

CC(F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:3:5:8.7:11.10.12|

BDBM277468

CCOCC(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:4:6:9.8:12.11.13|

BDBM277469

CN(C)CC(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:4:6:9.8:12.11.13|

BDBM757806

CCCC(SC)C(=O)N1[C@@H]2CC[C@H]1C[C@H](Nc1nc(Nc3cc(C)[nH]n3)cc3ncccc13)C2

BDBM277471

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)C3(CC3)C(=O)C(F)(F)F)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277472

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)C3(CC3)C(=O)C#N)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277473

COC(=O)C1(CC1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:7:9:12.11:15.14.16|

BDBM277474

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)C3(C)CCCC3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277475

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)Cc3ccccc3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277476

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccccc3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277477

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccncc3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277478

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccnc3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277479

CCC(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:2:4:11.10.12:8.6.7|

BDBM277480

CC(SO)C(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:4:6:13.12.14:10.8.9|

BDBM277481

CCOCC(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:4:6:13.12.14:10.8.9|

BDBM277482

CCC(SC)C(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:5:7:14.13.15:11.9.10|

BDBM277483

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)C3(CC3)C(=O)C(F)(F)F)n2)n[nH]1 |r,TLB:24:23:15.22.16:20.18.19|

BDBM277484

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)C3(CC3)C(=O)C#N)n2)n[nH]1 |r,TLB:24:23:15.22.16:20.18.19|

BDBM277485

COC(=O)C1(CC1)C(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:7:9:16.15.17:13.11.12|

BDBM487240

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)C(C)(C)CO)n2)n[nH]1 |TLB:24:23:18.19.20:22.15.16|

BDBM277487

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)C3(C)CCCC3)n2)n[nH]1 |r,TLB:24:23:15.22.16:20.18.19|

BDBM277488

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)Cc3ccccc3)n2)n[nH]1 |r,TLB:24:23:15.22.16:20.18.19|

BDBM277489

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)c3ccccc3)n2)n[nH]1 |r,TLB:24:23:15.22.16:20.18.19|

BDBM277490

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)c3cncc(c3)C#N)n2)n[nH]1 |r,TLB:24:23:15.22.16:20.18.19|

BDBM277491

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)CCCC#N)n2)n[nH]1 |r,TLB:24:23:15.22.16:20.18.19|

BDBM277492

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)c3ccc(nc3)C#N)n2)n[nH]1 |r,TLB:24:23:15.22.16:20.18.19|

BDBM277493

CC(CC#N)C(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:5:7:14.13.15:11.9.10|

BDBM277494

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)c3ccnc(c3)C#N)n2)n[nH]1 |r,TLB:24:23:15.22.16:20.18.19|

BDBM277495

CC(C)CCC(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:5:7:14.13.15:11.9.10|

BDBM277496

CCOC(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:3:5:8.7:11.10.12|

BDBM277497

CC(C)OC(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:4:6:9.8:12.11.13|

BDBM277498

CC(C)COC(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:5:7:10.9:13.12.14|

BDBM277499

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)OCC=C)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277500

COCCOC(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:5:7:10.9:13.12.14|

BDBM277501

CCOC(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:3:5:12.11.13:9.7.8|

BDBM277502

CC(C)COC(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:5:7:14.13.15:11.9.10|

BDBM277503

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)OCC=C)n2)n[nH]1 |r,TLB:24:23:15.22.16:20.18.19|

BDBM277504

COCCOC(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:5:7:14.13.15:11.9.10|

BDBM624911

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)OCC3CC3)n2)n[nH]1 |TLB:24:23:18.19.20:22.15.16|

BDBM277506

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)OCC#N)n2)n[nH]1 |r,TLB:24:23:15.22.16:20.18.19|

BDBM277507

CCC(C)OC(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:5:7:11.10.9:14.13.15|

BDBM624914

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)OCC3CCCCO3)n2)n[nH]1 |TLB:24:23:18.19.20:22.15.16|

BDBM757845

Cc1cc(Nc2cc3ncccc3c(N[C@@H]3C[C@H]4CCC[C@@H](C3)N4C(=O)CCC#N)n2)n[nH]1

BDBM277510

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(C)(=O)=O)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277511

CC(C)S(=O)(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:3:6:9.8:12.11.13|

BDBM277512

CC(C)CS(=O)(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:4:7:10.9:13.12.14|

BDBM277513

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)C3CC3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277514

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)C3CCCC3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277515

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)N3CCC3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277517

CCC1(CC1)S(=O)(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:5:8:11.10:14.13.15|

BDBM277516

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)C3(C)CC3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277518

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)C3CNC3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277519

CCN1CC(C1)S(=O)(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:6:9:12.11:15.14.16|

BDBM277520

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)C3CN(CCC#N)C3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277521

COCC1CCCN1S(=O)(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:8:11:14.13:17.16.18|

BDBM277522

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)Cc3ccccc3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277523

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)c3ccccn3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277524

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)c3cncc(F)c3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277525

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(C)(=O)=O)n2)n[nH]1 |r,TLB:24:23:20.19.18:15.22.16|

BDBM277526

CC(C)CS(=O)(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:4:7:11.10.9:14.13.15|

BDBM277527

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)C3CC3)n2)n[nH]1 |r,TLB:24:23:20.19.18:15.22.16|

BDBM277528

COCCS(=O)(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:4:7:11.10.9:14.13.15|

BDBM277529

CCC1(CC1)S(=O)(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:5:8:12.11.10:15.14.16|

BDBM277530

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)C3CNC3)n2)n[nH]1 |r,TLB:24:23:20.19.18:15.22.16|

BDBM277531

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)CC=C)n2)n[nH]1 |r,TLB:24:23:20.19.18:15.22.16|

BDBM277532

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)CC3CC3)n2)n[nH]1 |r,TLB:24:23:20.19.18:15.22.16|

BDBM277533

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)Cc3ccccc3)n2)n[nH]1 |r,TLB:24:23:20.19.18:15.22.16|

BDBM757870

Cc1cc(Nc2cc3ncccc3c(N[C@@H]3C[C@H]4CCC[C@@H](C3)N4S(=O)(=O)c3cnccc3C)n2)n[nH]1

BDBM277535

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)Cc3cccnc3)n2)n[nH]1 |r,TLB:24:23:20.19.18:15.22.16|

BDBM277536

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)N3CCCC3)n2)n[nH]1 |r,TLB:24:23:20.19.18:15.22.16|

BDBM487277

COCC1CCCN1S(=O)(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |TLB:8:11:13.14.15:17.18.19|

BDBM277538

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)N3CCC3)n2)n[nH]1 |r,TLB:24:23:20.19.18:15.22.16|

BDBM277539

COc1ccc2c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC(F)(F)F)nc(Nc3cc(C)[nH]n3)cc2n1 |r,TLB:16:15:12.11:8.14.9|

BDBM277540

COc1ccc2c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCCC#N)nc(Nc3cc(C)[nH]n3)cc2n1 |r,TLB:16:15:12.11:8.14.9|

BDBM277541

COc1ccc2c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCF)nc(Nc3cc(C)[nH]n3)cc2n1 |r,TLB:16:15:12.11:8.14.9|

BDBM277542

COc1ccc2c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC(C)C)nc(Nc3cc(C)[nH]n3)cc2n1 |r,TLB:16:15:12.11:8.14.9|

BDBM277543

COc1ccc2c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCCF)nc(Nc3cc(C)[nH]n3)cc2n1 |r,TLB:16:15:12.11:8.14.9|

BDBM277544

COc1ccc2c(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)C3(CC3)C(F)(F)F)nc(Nc3cc(C)[nH]n3)cc2n1 |r,TLB:16:15:12.11:8.14.9|

BDBM277545

COc1ccc2c(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)OCC=C)nc(Nc3cc(C)[nH]n3)cc2n1 |r,TLB:16:15:12.11:8.14.9|

BDBM277546

COc1ccc2c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCC#N)nc(Nc3cc(C)[nH]n3)cc2n1 |r,TLB:16:15:12.11:8.14.9|

BDBM277547

COc1ccc2c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(C)(=O)=O)nc(Nc3cc(C)[nH]n3)cc2n1 |r,TLB:16:15:12.11:8.14.9|

BDBM277548

COc1ccc2c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CCC#N)nc(Nc3cc(C)[nH]n3)cc2n1 |r,TLB:17:16:13.12.11:8.15.9|

BDBM487289

Cc1cc(Nc2cc3nc(CO)ccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCC#N)n2)n[nH]1 |r,TLB:25:24:21.20:18.17.23|

BDBM277550

Cc1cc(Nc2cc3nc(CO)ccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(C)(=O)=O)n2)n[nH]1 |r,TLB:25:24:21.20:17.23.18|

BDBM487292

Cc1cc(Nc2cc3nc(CO)ccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCCF)n2)n[nH]1 |r,TLB:25:24:21.20:18.17.23|

BDBM277553

Cc1cc(Nc2cc3nc(CN4CCOCC4)ccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(C)(=O)=O)n2)n[nH]1 |r,TLB:30:29:26.25:22.28.23|

BDBM277554

CCS(=O)(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2nc(CN3CCOCC3)ccc12 |r,TLB:2:5:8.7:11.10.12|

BDBM277555

Cc1cc(Nc2cc3nc(CN4CCOCC4)ccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)OCC=C)n2)n[nH]1 |r,TLB:30:29:26.25:22.28.23|

BDBM277556

Cc1cc(Nc2cc3nc(CN4CCOCC4)ccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCC#N)n2)n[nH]1 |r,TLB:30:29:26.25:22.28.23|

BDBM277557

CC(C)CN1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2nc(CN3CCOCC3)ccc12 |r,TLB:3:4:7.6:10.9.11|

BDBM277558

Cc1cc(Nc2cc3nc(CN4CCOCC4)ccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)c3cncc(F)c3)n2)n[nH]1 |r,TLB:30:29:26.25:22.28.23|

BDBM277559

Cc1cc(Nc2cc3nc(CN4CCOCC4)ccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)N3CCC3)n2)n[nH]1 |r,TLB:30:29:26.25:22.28.23|

BDBM277560

Cc1cc(Nc2cc3nc(CN4CCOCC4)ccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(C)(=O)=O)n2)n[nH]1 |r,TLB:31:30:27.26.25:22.29.23|

BDBM277561

CCS(=O)(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2nc(CN3CCOCC3)ccc12 |r,TLB:2:5:9.8.7:12.11.13|

BDBM277562

COCCS(=O)(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2nc(CN3CCOCC3)ccc12 |r,TLB:4:7:11.10.9:14.13.15|

BDBM277563

Cc1cc(Nc2cc3nc(CN4CCOCC4)ccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)OCC=C)n2)n[nH]1 |r,TLB:31:30:27.26.25:22.29.23|

BDBM277564

Cc1cc(Nc2cc3nc(CN4CCOCC4)ccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CCC#N)n2)n[nH]1 |r,TLB:31:30:27.26.25:22.29.23|

BDBM757901

Cc1cc(Nc2cc3nc(CN4CCOCC4)ccc3c(N[C@@H]3C[C@H]4CCC[C@@H](C3)N4c3cccnc3)n2)n[nH]1

BDBM757902

Cc1cc(Nc2cc3nc(CN4CCOCC4)ccc3c(N[C@@H]3C[C@H]4CCC[C@@H](C3)N4N3CCC3)n2)n[nH]1

BDBM277567

Cc1cc(Nc2cc3nc(CN4CCOCC4)ccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CC(F)(F)F)n2)n[nH]1 |r,TLB:31:30:27.26.25:22.29.23|

BDBM277568

Cc1cc(Nc2cc3nc(CN4CCOCC4)ccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)c3cncc(F)c3)n2)n[nH]1 |r,TLB:31:30:27.26.25:22.29.23|

BDBM277569

Cc1cc(Nc2cc3nc(CN4CCC(F)(F)CC4)ccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)c3cncc(F)c3)n2)n[nH]1 |r,TLB:32:31:28.27:24.30.25|

BDBM277570

CCC1(CC1)S(=O)(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2nc(CN3CCC(F)(F)CC3)ccc12 |r,TLB:5:8:11.10:14.13.15|

BDBM757907

Cc1cc(Nc2cc3nc(CN4CCC(F)(F)CC4)ccc3c(N[C@@H]3C[C@H]4CC[C@@H](C3)N4S(=O)(=O)CC(F)(F)F)n2)n[nH]1

BDBM757908

Cc1cc(Nc2cc3nc(CN4CCC(F)(F)CC4)ccc3c(N[C@@H]3C[C@H]4CC[C@@H](C3)N4S(=O)(=O)CC(C)C)n2)n[nH]1

BDBM757909

Cc1cc(Nc2cc3nc(CN4CCN(C)CC4)ccc3c(N[C@@H]3C[C@H]4CC[C@@H](C3)N4S(=O)(=O)CC(F)(F)F)n2)n[nH]1

BDBM487314

CCC1(CC1)S(=O)(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2nc(CN3CCN(C)CC3)ccc12 |THB:5:8:10.11:13.14.15|

BDBM277575

CN1CCN(Cc2ccc3c(N[C@H]4C[C@@H]5CC[C@H](C4)N5CCC#N)nc(Nc4cc(C)[nH]n4)cc3n2)CC1 |r,TLB:20:19:16.15:12.18.13|

BDBM277576

CC(C)CN1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2nc(CN3CCN(C)CC3)ccc12 |r,TLB:3:4:7.6:10.9.11|

BDBM277577

CN1CCN(Cc2ccc3c(N[C@H]4C[C@@H]5CC[C@H](C4)N5S(=O)(=O)N4CCC4)nc(Nc4cc(C)[nH]n4)cc3n2)CC1 |r,TLB:20:19:16.15:12.18.13|

BDBM277578

CN1CCN(Cc2ccc3c(N[C@H]4C[C@@H]5CC[C@H](C4)N5S(=O)(=O)c4cncc(F)c4)nc(Nc4cc(C)[nH]n4)cc3n2)CC1 |r,TLB:20:19:16.15:12.18.13|

BDBM277579

Cc1cc(Nc2cc3nc(CS(C)(=O)=O)ccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCF)n2)n[nH]1 |r,TLB:28:27:24.23:20.26.21|

BDBM757916

C=S(C)(=O)Cc1ccc2c(N[C@@H]3C[C@H]4CC[C@@H](C3)N4CCCF)nc(Nc3cc(C)[nH]n3)cc2n1

BDBM757917

C=S(C)(=O)Cc1ccc2c(N[C@@H]3C[C@H]4CC[C@@H](C3)N4CCC(F)(F)F)nc(Nc3cc(C)[nH]n3)cc2n1

BDBM277582

Cc1cc(Nc2cc3ncc(C)cc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCC#N)n2)n[nH]1 |r,TLB:24:23:20.19:16.22.17|

BDBM757919

Cc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@@H]3C[C@H]4CC[C@@H](C3)N4Cc3cccnc3)c2c1

BDBM277584

CC(C)COC(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncc(C)cc12 |r,TLB:5:7:10.9:13.12.14|

BDBM277585

Cc1cc(Nc2cc3ncc(C)cc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)N3CC(C3)C#N)n2)n[nH]1 |r,TLB:24:23:20.19:16.22.17|

BDBM277586

Cc1cc(Nc2cc3ncc(C)cc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(C)(=O)=O)n2)n[nH]1 |r,TLB:24:23:20.19:16.22.17|

BDBM277587

Cc1cc(Nc2cc3ncc(C)cc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CCC#N)n2)n[nH]1 |r,TLB:25:24:21.20.19:16.23.17|

BDBM277588

CC(C)COC(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncc(C)cc12 |r,TLB:5:7:11.10.9:14.13.15|

BDBM487329

Cc1cc(Nc2cc3ncc(C)cc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(C)(=O)=O)n2)n[nH]1 |THB:25:24:19.20.21:16.17.23|

BDBM277590

Cc1cc(Nc2cc3ncc(C)cc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)N3CC(C3)C#N)n2)n[nH]1 |r,TLB:25:24:21.20.19:16.23.17|

BDBM277591

Cc1cc(Nc2cc3ncc(C)cc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4Cc3ccncc3)n2)n[nH]1 |r,TLB:25:24:21.20.19:16.23.17|

BDBM277592

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCC#N)c2c1 |r,TLB:26:25:22.21:18.24.19|

BDBM277593

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCCC#N)c2c1 |r,TLB:26:25:22.21:18.24.19|

BDBM277594

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCF)c2c1 |r,TLB:26:25:22.21:18.24.19|

BDBM277595

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC(C)C)c2c1 |r,TLB:26:25:22.21:18.24.19|

BDBM277596

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCC(F)(F)F)c2c1 |r,TLB:26:25:22.21:18.24.19|

BDBM277597

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCCF)c2c1 |r,TLB:26:25:22.21:18.24.19|

BDBM277598

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC(F)(F)F)c2c1 |r,TLB:26:25:22.21:18.24.19|

BDBM277599

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(C)(=O)=O)c2c1 |r,TLB:26:25:22.21:18.24.19|

BDBM277600

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)OCC=C)c2c1 |r,TLB:26:25:22.21:18.24.19|

BDBM277601

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)N3CC(C3)C#N)c2c1 |r,TLB:26:25:22.21:18.24.19|

BDBM277602

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)CCCC#N)c2c1 |r,TLB:26:25:22.21:18.24.19|

BDBM277603

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)CCC#N)c2c1 |r,TLB:26:25:22.21:18.24.19|

BDBM277604

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)CC3(CC3)C#N)c2c1 |r,TLB:26:25:22.21:18.24.19|

BDBM625011

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)Cc3ccncc3)c2c1 |r,TLB:26:25:19.18.24:22.21|

BDBM487346

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)OCC(C)C)c2c1 |r,TLB:26:25:22.21:19.18.24|

BDBM277607

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CCCF)c2c1 |r,TLB:27:26:23.22.21:18.25.19|

BDBM487348

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)C(C)SO)c2c1 |THB:27:26:21.22.23:18.19.25|

BDBM277609

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4Cc3ccncc3)c2c1 |r,TLB:27:26:23.22.21:18.25.19|

BDBM277610

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(C)(=O)=O)c2c1 |r,TLB:27:26:23.22.21:18.25.19|

BDBM277611

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)CN(C)C)c2c1 |r,TLB:27:26:23.22.21:18.25.19|

BDBM277612

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CCC#N)c2c1 |r,TLB:27:26:23.22.21:18.25.19|

BDBM277613

COC(=O)c1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCC#N)c2c1 |r,TLB:28:27:24.23:20.26.21|

BDBM277614

COC(=O)c1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(C)(=O)=O)c2c1 |r,TLB:28:27:24.23:20.26.21|

BDBM277615

CCS(=O)(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncc(cc12)C(=O)OC |r,TLB:2:5:8.7:11.10.12|

BDBM277616

COC(=O)c1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4C3CCOC3=O)c2c1 |r,TLB:28:27:24.23:20.26.21|

BDBM277617

CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncc(cc12)C(=O)OC |r,TLB:2:4:7.6:10.9.11|

BDBM625024

COC(=O)c1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)C(F)F)c2c1 |r,TLB:28:27:21.20.26:24.23|

BDBM487359

CCC(SC)C(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncc(cc12)C(=O)OC |r,TLB:5:7:10.9:14.13.12|

BDBM277620

COC(=O)c1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CN(C)C)c2c1 |r,TLB:28:27:24.23:20.26.21|

BDBM277621

COC(=O)c1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)OCC=C)c2c1 |r,TLB:28:27:24.23:20.26.21|

BDBM277622

COC(=O)c1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC(=O)OC(C)C)c2c1 |r,TLB:28:27:24.23:20.26.21|

BDBM277623

CNC(=O)CN1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncc(cc12)C(=O)OC |r,TLB:4:5:8.7:11.10.12|

BDBM277624

COC(=O)c1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCF)c2c1 |r,TLB:28:27:24.23:20.26.21|

BDBM277625

COC(=O)c1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCCF)c2c1 |r,TLB:28:27:24.23:20.26.21|

BDBM277626

COC(=O)c1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCC(F)(F)F)c2c1 |r,TLB:28:27:24.23:20.26.21|

BDBM277627

COC(=O)c1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4C[C@H]3CCC(=O)O3)c2c1 |r,TLB:28:27:24.23:20.26.21|

BDBM757964

COC(=O)c1ccc2c(N[C@@H]3C[C@H]4CCC[C@@H](C3)N4CCC#N)nc(Nc3cc(C)[nH]n3)cc2n1

BDBM757965

COC(=O)c1ccc2c(N[C@@H]3C[C@H]4CCC[C@@H](C3)N4C3CCCOC3=O)nc(Nc3cc(C)[nH]n3)cc2n1

BDBM757966

COC(=O)c1ccc2c(N[C@@H]3C[C@H]4CCC[C@@H](C3)N4C[C@H]3CCC(=O)O3)nc(Nc3cc(C)[nH]n3)cc2n1

BDBM277631

Cc1cc(Nc2cc3ncc(cc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCC#N)n2)S(C)(=O)=O)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277632

Cc1cc(Nc2cc3ncc(cc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CC#N)n2)S(C)(=O)=O)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277633

Cc1cc(Nc2cc3ncc(cc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)C(F)F)n2)S(C)(=O)=O)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM487374

CCC(SC)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncc(cc12)S(C)(=O)=O |r,TLB:2:5:8.7:12.11.10|

BDBM277635

Cc1cc(Nc2cc3ncc(cc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCF)n2)S(C)(=O)=O)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277636

Cc1cc(Nc2cc3ncc(cc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCCF)n2)S(C)(=O)=O)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277637

Cc1cc(Nc2cc3ncc(cc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCC(F)(F)F)n2)S(C)(=O)=O)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277638

Cc1cc(Nc2cc3ncc(cc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4[C@@H]3CCOC3=O)n2)S(C)(=O)=O)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277639

Cc1cc(Nc2cc3ncc(cc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4[C@H]3CCOC3=O)n2)S(C)(=O)=O)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277640

Cc1cc(Nc2cc3ncc(cc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4Cc3ccncc3)n2)S(C)(=O)=O)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277641

Cc1cc(Nc2cc3ncc(cc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4Cc3ccncc3)n2)S(C)(=O)=O)n[nH]1 |r,TLB:24:23:20.19.18:15.22.16|

BDBM277642

COc1ccnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)OCC(C)C)c12 |r,TLB:27:26:23.22:19.25.20|

BDBM277643

CCS(=O)(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2nccc(OC)c12 |r,TLB:2:5:8.7:11.10.12|

BDBM277644

COc1ccnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CN(C)C)c12 |r,TLB:27:26:23.22:19.25.20|

BDBM277645

CCC(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2nccc(OC)c12 |r,TLB:4:6:9.8:12.11.13|

BDBM277646

COc1ccnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)C(F)F)c12 |r,TLB:27:26:23.22:19.25.20|

BDBM277647

COc1ccnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCC#N)c12 |r,TLB:27:26:23.22:19.25.20|

BDBM277648

COc1ccnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCF)c12 |r,TLB:27:26:23.22:19.25.20|

BDBM277649

COc1ccnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC(F)F)c12 |r,TLB:27:26:23.22:19.25.20|

BDBM277650

COc1ccnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC(F)(F)F)c12 |r,TLB:27:26:23.22:19.25.20|

BDBM625057

COc1ccnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4C3(CC#N)COC3)c12 |TLB:27:26:22.23:19.20.25|

BDBM277652

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCC#N)c3cccnc3c2F)n[nH]1 |r,TLB:17:16:13.12:9.15.10|

BDBM277653

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(C)(=O)=O)c3cccnc3c2F)n[nH]1 |r,TLB:17:16:13.12:9.15.10|

BDBM277654

CCS(=O)(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)c(F)c2ncccc12 |r,TLB:2:5:8.7:11.10.12|

BDBM277655

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)c3cccnc3)c3cccnc3c2F)n[nH]1 |r,TLB:17:16:13.12:9.15.10|

BDBM277656

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)c3cncc(F)c3)c3cccnc3c2F)n[nH]1 |r,TLB:17:16:13.12:9.15.10|

BDBM625063

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)Cc3ccncc3)c3cccnc3c2F)n[nH]1 |THB:17:16:12.13:15.9.10|

BDBM277658

CN(C)CC(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)c(F)c2ncccc12 |r,TLB:4:6:9.8:12.11.13|

BDBM277659

CC(SO)C(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)c(F)c2ncccc12 |r,TLB:4:6:9.8:12.11.13|

BDBM487390

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CCC#N)c3cccnc3c2F)n[nH]1 |r,TLB:18:17:14.13.12:10.9.16|

BDBM277661

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(C)(=O)=O)c3cccnc3c2F)n[nH]1 |r,TLB:18:17:9.16.10:12.14.13|

BDBM487392

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)c3ccccc3)c3cccnc3c2F)n[nH]1 |r,TLB:18:17:14.13.12:10.9.16|

BDBM277667

Cc6cc(Nc5nc(N[C@@H]1C[C@H]2CCC[C@@H](C1)N2S(=O)(=O)c3cccnc3)c4cccnc4c5F)n[nH]6

BDBM277664

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)c3cncc(F)c3)c3cccnc3c2F)n[nH]1 |r,TLB:18:17:9.16.10:12.14.13|

BDBM277665

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)Cc3ccncc3)c3cccnc3c2F)n[nH]1 |r,TLB:18:17:9.16.10:12.14.13|

BDBM487397

CC(SO)C(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)c(F)c2ncccc12 |r,TLB:4:6:10.9.8:14.13.12|

BDBM277668

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(C)(=O)=O)c3cc(C)cnc3c2F)n[nH]1 |r,TLB:17:16:13.12:9.15.10|

BDBM277669

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCC#N)c3cc(C)cnc3c2F)n[nH]1 |r,TLB:17:16:13.12:9.15.10|

BDBM277670

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)N3CC(C3)C#N)c3cc(C)cnc3c2F)n[nH]1 |r,TLB:17:16:13.12:9.15.10|

BDBM277671

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)c3cccnc3)c3cc(C)cnc3c2F)n[nH]1 |r,TLB:17:16:13.12:9.15.10|

BDBM277672

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CCC#N)c3cc(C)cnc3c2F)n[nH]1 |r,TLB:18:17:9.16.10:12.14.13|

BDBM277673

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(C)(=O)=O)c3cc(C)cnc3c2F)n[nH]1 |r,TLB:18:17:9.16.10:12.14.13|

BDBM277674

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)N3CC(C3)C#N)c3cc(C)cnc3c2F)n[nH]1 |r,TLB:18:17:9.16.10:12.14.13|

BDBM277675

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)c3cccnc3)c3cc(C)cnc3c2F)n[nH]1 |r,TLB:18:17:9.16.10:12.14.13|

BDBM239953

Cn1cc(Nc2ncc(Cl)c(NC3CC4CN(CC4C3)C(=O)CC#N)n2)cn1

BDBM239955

Cn1cc(Nc2ncc(Cl)c(NC3CCC4(CCN(C4)C(=O)CC#N)CC3)n2)cn1 |(3.63,-2.93,;2.09,-2.93,;1.18,-4.18,;-.28,-3.7,;-1.62,-4.47,;-2.95,-3.7,;-4.28,-4.47,;-5.62,-3.7,;-5.62,-2.16,;-6.95,-1.39,;-4.28,-1.39,;-4.28,.15,;-2.95,.92,;-1.62,.15,;-.28,.92,;-.28,2.46,;-.28,4,;1.18,4.47,;2.09,3.23,;1.18,1.98,;3.58,2.83,;4.66,3.92,;3.97,1.34,;5.46,.94,;6.95,.54,;-1.62,3.23,;-2.95,2.46,;-2.95,-2.16,;-.28,-2.16,;1.18,-1.69,)|

BDBM239963

CC(=O)N1CCC2(CCC(CC2)Nc2nc(Nc3cnn(C)c3)ncc2Cl)CC1

BDBM239966

Cn1cc(Nc2ncc(Cl)c(NC3CC4CN(CC4C3)S(C)(=O)=O)n2)cn1

BDBM254978

O=C1NCN(C2CCCCC2)c2c1cnc1[nH]ccc21

BDBM254979

FC(F)(Br)CNC[C@H]1CC[C@@H](CC1)N1CNC(=O)c2cnc3[nH]ccc3c12 |r,wU:10.13,wD:7.6,(7.34,3.85,;6,3.08,;6,1.54,;7.34,2.31,;4.67,3.85,;3.33,3.08,;2,3.85,;.67,3.08,;-.67,3.85,;-2,3.08,;-2,1.54,;-.67,.77,;.67,1.54,;-3.33,.77,;-4.67,1.54,;-6,.77,;-6,-.77,;-7.34,-1.54,;-4.67,-1.54,;-4.67,-3.08,;-3.33,-3.85,;-2,-3.08,;-.54,-3.56,;.37,-2.31,;-.54,-1.06,;-2,-1.54,;-3.33,-.77,)|

BDBM254998

CN1CN(C2CCCCC2)c2c(cnc3[nH]ccc23)C1=O

BDBM254999

FC(F)(F)CNC[C@H]1CC[C@@H](CC1)N1CNC(=O)c2cnc3[nH]ccc3c12 |r,wU:10.13,wD:7.6,(2.59,-9.23,;1.78,-7.92,;3.09,-7.11,;.47,-8.73,;.97,-6.61,;1.69,-5.25,;.88,-3.94,;1.61,-2.59,;3.15,-2.54,;3.88,-1.18,;3.07,.13,;1.53,.08,;.8,-1.28,;3.79,1.49,;5.33,1.53,;6.06,2.89,;5.25,4.2,;5.98,5.56,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,;2.98,2.79,)|

BDBM255000

O=C1N(CC#N)CN(C2CCCCC2)c2c1cnc1[nH]ccc21

BDBM255001

CS(=O)(=O)NC[C@H]1CC[C@@H](CC1)N1CN(CC(F)(F)F)C(=O)c2cnc3[nH]ccc3c12 |r,wU:9.12,wD:6.5,(-.03,-6.08,;-1.39,-5.35,;-2.11,-6.7,;-2.74,-4.62,;-.66,-3.99,;.88,-3.94,;1.61,-2.59,;3.15,-2.54,;3.88,-1.18,;3.07,.13,;1.53,.08,;.8,-1.28,;3.79,1.49,;5.33,1.53,;6.06,2.89,;7.6,2.94,;8.33,4.3,;9.06,5.65,;6.97,5.02,;9.69,3.57,;5.25,4.2,;5.98,5.56,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,;2.98,2.79,)|

BDBM255002

FC(F)(F)CN1CN([C@H]2CC[C@H](CNS(=O)(=O)C3CC3)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:8.7,wD:11.11,(9.06,5.65,;8.33,4.3,;6.97,5.02,;9.69,3.57,;7.6,2.94,;6.06,2.89,;5.33,1.53,;3.79,1.49,;3.07,.13,;3.88,-1.18,;3.15,-2.54,;1.61,-2.59,;.88,-3.94,;1.69,-5.25,;.97,-6.61,;-.39,-5.88,;2.32,-7.34,;.24,-7.97,;.29,-9.5,;-1.07,-8.78,;.8,-1.28,;1.53,.08,;2.98,2.79,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,;5.25,4.2,;5.98,5.56,)|

BDBM255003

OC[C@H]1CC[C@@H](CC1)N1CN(CC#N)C(=O)c2cnc3[nH]ccc3c12 |r,wU:5.8,wD:2.1,(1.69,-5.25,;.88,-3.94,;1.61,-2.59,;3.15,-2.54,;3.88,-1.18,;3.07,.13,;1.53,.08,;.8,-1.28,;3.79,1.49,;5.33,1.53,;6.06,2.89,;7.6,2.94,;8.33,4.3,;9.06,5.65,;5.25,4.2,;5.98,5.56,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,;2.98,2.79,)|

BDBM255004

O=C1N(CN([C@H]2CC[C@H](CNCC#N)CC2)c2c1cnc1[nH]ccc21)C1CC1 |r,wU:5.4,wD:8.8,(9.57,-1.94,;8.84,-.59,;9.65,.72,;8.92,2.08,;7.38,2.13,;6.66,3.48,;5.12,3.53,;4.39,4.89,;5.2,6.2,;4.47,7.56,;2.93,7.6,;2.21,8.96,;.67,9.01,;-.87,9.06,;6.74,6.15,;7.47,4.79,;6.57,.82,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;11.19,.67,;12.55,1.4,;12.5,-.14,)|

BDBM255005

CCN1CN([C@H]2CC[C@H](CNCC#N)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:5.4,wD:8.8,(11.92,-.68,;11.19,.67,;9.65,.72,;8.92,2.08,;7.38,2.13,;6.66,3.48,;5.12,3.53,;4.39,4.89,;5.2,6.2,;4.47,7.56,;2.93,7.6,;2.21,8.96,;.67,9.01,;-.87,9.06,;6.74,6.15,;7.47,4.79,;6.57,.82,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;8.84,-.59,;9.57,-1.94,)|

BDBM255006

FC(F)(F)CN1CN([C@H]2CC[C@H](CNCC#N)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:8.7,wD:11.11,(9.06,5.65,;8.33,4.3,;6.97,5.02,;9.69,3.57,;7.6,2.94,;6.06,2.89,;5.33,1.53,;3.79,1.49,;3.07,.13,;3.88,-1.18,;3.15,-2.54,;1.61,-2.59,;.88,-3.94,;1.69,-5.25,;.97,-6.61,;1.78,-7.92,;2.59,-9.23,;.8,-1.28,;1.53,.08,;2.98,2.79,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,;5.25,4.2,;5.98,5.56,)|

BDBM255007

CN1CN([C@H]2CC[C@H](CNCC(F)(F)F)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:4.3,wD:7.7,(11.19,.67,;9.65,.72,;8.92,2.08,;7.38,2.13,;6.66,3.48,;5.12,3.53,;4.39,4.89,;5.2,6.2,;4.47,7.56,;2.93,7.6,;2.21,8.96,;.67,9.01,;-.87,9.06,;.71,10.55,;.62,7.47,;6.74,6.15,;7.47,4.79,;6.57,.82,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;8.84,-.59,;9.57,-1.94,)|

BDBM255008

CN1CN([C@H]2CC[C@@H](CC2)C(F)F)c2c(cnc3[nH]ccc23)C1=O |r,wU:4.3,wD:7.10,(7.6,2.94,;6.06,2.89,;5.33,1.53,;3.79,1.49,;3.07,.13,;3.88,-1.18,;3.15,-2.54,;1.61,-2.59,;.8,-1.28,;1.53,.08,;.88,-3.94,;1.69,-5.25,;-.66,-3.99,;2.98,2.79,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,;5.25,4.2,;5.98,5.56,)|

BDBM255009

CN1CN([C@H]2CC[C@H](CF)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:4.3,wD:7.7,(7.6,2.94,;6.06,2.89,;5.33,1.53,;3.79,1.49,;3.07,.13,;3.88,-1.18,;3.15,-2.54,;1.61,-2.59,;.88,-3.94,;1.69,-5.25,;.8,-1.28,;1.53,.08,;2.98,2.79,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,;5.25,4.2,;5.98,5.56,)|

BDBM255010

FC(F)(F)C1(CC1)NC[C@H]1CC[C@@H](CC1)N1CNC(=O)c2cnc3[nH]ccc3c12 |r,wU:12.16,wD:9.9,(-1.96,-5.65,;-.5,-6.13,;-.98,-7.59,;-.02,-4.66,;.97,-6.61,;2.18,-7.56,;.75,-8.13,;1.69,-5.25,;.88,-3.94,;1.61,-2.59,;3.15,-2.54,;3.88,-1.18,;3.07,.13,;1.53,.08,;.8,-1.28,;3.79,1.49,;5.33,1.53,;6.06,2.89,;5.25,4.2,;5.98,5.56,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,;2.98,2.79,)|

BDBM255011

CN1CN([C@H]2CC[C@H](CNCC(F)F)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:4.3,wD:7.7,(7.6,2.94,;6.06,2.89,;5.33,1.53,;3.79,1.49,;3.07,.13,;3.88,-1.18,;3.15,-2.54,;1.61,-2.59,;.88,-3.94,;1.69,-5.25,;.97,-6.61,;1.78,-7.92,;1.05,-9.27,;3.32,-7.87,;.8,-1.28,;1.53,.08,;2.98,2.79,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,;5.25,4.2,;5.98,5.56,)|

BDBM255012

CN(CC#N)C[C@H]1CC[C@@H](CC1)N1CN(C)C(=O)c2cnc3[nH]ccc3c12 |r,wU:9.12,wD:6.5,(3.23,-5.2,;1.69,-5.25,;.97,-6.61,;1.78,-7.92,;2.59,-9.23,;.88,-3.94,;1.61,-2.59,;3.15,-2.54,;3.88,-1.18,;3.07,.13,;1.53,.08,;.8,-1.28,;3.79,1.49,;5.33,1.53,;6.06,2.89,;7.6,2.94,;5.25,4.2,;5.98,5.56,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,;2.98,2.79,)|

BDBM255013

CN1CN([C@H]2CC[C@H](CNCC#N)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:7.7,wD:4.3,(11.19,.67,;9.65,.72,;8.92,2.08,;7.38,2.13,;6.66,3.48,;7.47,4.79,;6.74,6.15,;5.2,6.2,;4.47,7.56,;2.93,7.6,;2.21,8.96,;.67,9.01,;-.87,9.06,;4.39,4.89,;5.12,3.53,;6.57,.82,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;8.84,-.59,;9.57,-1.94,)|

BDBM255014

CN(C[C@H]1CC[C@@H](CC1)N1CN(C)C(=O)c2cnc3[nH]ccc3c12)S(C)(=O)=O |r,wU:6.9,wD:3.2,(3.23,-5.2,;1.69,-5.25,;.88,-3.94,;1.61,-2.59,;3.15,-2.54,;3.88,-1.18,;3.07,.13,;1.53,.08,;.8,-1.28,;3.79,1.49,;5.33,1.53,;6.06,2.89,;7.6,2.94,;5.25,4.2,;5.98,5.56,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,;2.98,2.79,;.97,-6.61,;-.39,-5.88,;.24,-7.97,;2.32,-7.34,)|

BDBM255015

COCCN1CN([C@H]2CC[C@H](CNCC(F)(F)F)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:7.6,wD:10.10,(14.19,-2.09,;13.46,-.73,;11.92,-.68,;11.19,.67,;9.65,.72,;8.92,2.08,;7.38,2.13,;6.66,3.48,;5.12,3.53,;4.39,4.89,;5.2,6.2,;4.47,7.56,;2.93,7.6,;2.21,8.96,;.67,9.01,;-.87,9.06,;.71,10.55,;.62,7.47,;6.74,6.15,;7.47,4.79,;6.57,.82,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;8.84,-.59,;9.57,-1.94,)|

BDBM255016

CSCN1CN([C@H]2CC[C@H](CNCC(F)(F)F)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:6.5,wD:9.9,(13.46,-.73,;11.92,-.68,;11.19,.67,;9.65,.72,;8.92,2.08,;7.38,2.13,;6.66,3.48,;5.12,3.53,;4.39,4.89,;5.2,6.2,;4.47,7.56,;2.93,7.6,;2.21,8.96,;.67,9.01,;-.87,9.06,;.71,10.55,;.62,7.47,;6.74,6.15,;7.47,4.79,;6.57,.82,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;8.84,-.59,;9.57,-1.94,)|

BDBM255017

FC(F)(F)CNC[C@H]1CC[C@@H](CC1)N1CN(CC(F)(F)F)C(=O)c2cnc3[nH]ccc3c12 |r,wU:10.13,wD:7.6,(-.87,9.06,;.67,9.01,;.71,10.55,;.62,7.47,;2.21,8.96,;2.93,7.6,;4.47,7.56,;5.2,6.2,;4.39,4.89,;5.12,3.53,;6.66,3.48,;7.47,4.79,;6.74,6.15,;7.38,2.13,;8.92,2.08,;9.65,.72,;11.19,.67,;11.92,-.68,;12.65,-2.04,;13.28,.04,;10.56,-1.41,;8.84,-.59,;9.57,-1.94,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;6.57,.82,)|

BDBM255018

COCN1CN([C@H]2CC[C@H](CNCC(F)(F)F)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:6.5,wD:9.9,(13.46,-.73,;11.92,-.68,;11.19,.67,;9.65,.72,;8.92,2.08,;7.38,2.13,;6.66,3.48,;5.12,3.53,;4.39,4.89,;5.2,6.2,;4.47,7.56,;2.93,7.6,;2.21,8.96,;.67,9.01,;-.87,9.06,;.71,10.55,;.62,7.47,;6.74,6.15,;7.47,4.79,;6.57,.82,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;8.84,-.59,;9.57,-1.94,)|

BDBM255019

CN1CN([C@H]2CC[C@H](CNC3CC3)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:4.3,wD:7.7,(7.6,2.94,;6.06,2.89,;5.33,1.53,;3.79,1.49,;3.07,.13,;3.88,-1.18,;3.15,-2.54,;1.61,-2.59,;.88,-3.94,;1.69,-5.25,;.97,-6.61,;1.01,-8.15,;-.34,-7.42,;.8,-1.28,;1.53,.08,;2.98,2.79,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,;5.25,4.2,;5.98,5.56,)|

BDBM255020

FC(F)(F)CNC[C@H]1CC[C@@H](CC1)N1CN(CC2CC2)C(=O)c2cnc3[nH]ccc3c12 |r,wU:10.13,wD:7.6,(-.87,9.06,;.67,9.01,;.71,10.55,;.62,7.47,;2.21,8.96,;2.93,7.6,;4.47,7.56,;5.2,6.2,;4.39,4.89,;5.12,3.53,;6.66,3.48,;7.47,4.79,;6.74,6.15,;7.38,2.13,;8.92,2.08,;9.65,.72,;11.19,.67,;11.92,-.68,;13.23,-1.49,;11.87,-2.22,;8.84,-.59,;9.57,-1.94,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;6.57,.82,)|

BDBM255021

FC(F)(F)CNC[C@H]1CC[C@@H](CC1)N1CN(CC2CCCO2)C(=O)c2cnc3[nH]ccc3c12 |r,wU:10.13,wD:7.6,(-.87,9.06,;.67,9.01,;.71,10.55,;.62,7.47,;2.21,8.96,;2.93,7.6,;4.47,7.56,;5.2,6.2,;4.39,4.89,;5.12,3.53,;6.66,3.48,;7.47,4.79,;6.74,6.15,;7.38,2.13,;8.92,2.08,;9.65,.72,;11.19,.67,;11.92,-.68,;13.44,-.89,;13.72,-2.41,;12.36,-3.14,;11.25,-2.07,;8.84,-.59,;9.57,-1.94,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;6.57,.82,)|

BDBM255022

FC(F)(F)CNC[C@H]1CC[C@@H](CC1)N1CN(CCCC#N)C(=O)c2cnc3[nH]ccc3c12 |r,wU:10.13,wD:7.6,(2.59,-9.23,;1.78,-7.92,;.47,-8.73,;3.09,-7.11,;.97,-6.61,;1.69,-5.25,;.88,-3.94,;1.61,-2.59,;3.15,-2.54,;3.88,-1.18,;3.07,.13,;1.53,.08,;.8,-1.28,;3.79,1.49,;5.33,1.53,;6.06,2.89,;7.6,2.94,;8.33,4.3,;9.87,4.34,;10.6,5.7,;11.32,7.06,;5.25,4.2,;5.98,5.56,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,;2.98,2.79,)|

BDBM255023

FC(F)(F)CNC[C@H]1CC[C@@H](CC1)N1CN(C2CC2)C(=O)c2cnc3[nH]ccc3c12 |r,wU:10.13,wD:7.6,(-.87,9.06,;.67,9.01,;.71,10.55,;.62,7.47,;2.21,8.96,;2.93,7.6,;4.47,7.56,;5.2,6.2,;4.39,4.89,;5.12,3.53,;6.66,3.48,;7.47,4.79,;6.74,6.15,;7.38,2.13,;8.92,2.08,;9.65,.72,;11.19,.67,;12.55,1.4,;12.5,-.14,;8.84,-.59,;9.57,-1.94,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;6.57,.82,)|

BDBM255024

CCN1CN([C@H]2CC[C@H](CNCC(F)(F)F)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:5.4,wD:8.8,(11.92,-.68,;11.19,.67,;9.65,.72,;8.92,2.08,;7.38,2.13,;6.66,3.48,;5.12,3.53,;4.39,4.89,;5.2,6.2,;4.47,7.56,;2.93,7.6,;2.21,8.96,;.67,9.01,;-.87,9.06,;.71,10.55,;.62,7.47,;6.74,6.15,;7.47,4.79,;6.57,.82,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;8.84,-.59,;9.57,-1.94,)|

BDBM255025

CN(C)C(=O)CN1CN([C@H]2CC[C@H](CNCC(F)(F)F)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:9.8,wD:12.12,(14.19,-2.09,;13.46,-.73,;14.27,.58,;11.92,-.68,;11.11,-1.99,;11.19,.67,;9.65,.72,;8.92,2.08,;7.38,2.13,;6.66,3.48,;5.12,3.53,;4.39,4.89,;5.2,6.2,;4.47,7.56,;2.93,7.6,;2.21,8.96,;.67,9.01,;-.87,9.06,;.71,10.55,;.62,7.47,;6.74,6.15,;7.47,4.79,;6.57,.82,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;8.84,-.59,;9.57,-1.94,)|

BDBM255026

CN(C[C@H]1CC[C@@H](CC1)N1CN(CC(F)(F)F)C(=O)c2cnc3[nH]ccc3c12)S(C)(=O)=O |r,wU:6.9,wD:3.2,(3.23,-5.2,;1.69,-5.25,;.88,-3.94,;1.61,-2.59,;3.15,-2.54,;3.88,-1.18,;3.07,.13,;1.53,.08,;.8,-1.28,;3.79,1.49,;5.33,1.53,;6.06,2.89,;7.6,2.94,;8.33,4.3,;9.06,5.65,;9.69,3.57,;6.97,5.02,;5.25,4.2,;5.98,5.56,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,;2.98,2.79,;.97,-6.61,;-.39,-5.88,;.24,-7.97,;2.32,-7.34,)|

BDBM255027

CN(C[C@H]1CC[C@@H](CC1)N1CN(C2CC2)C(=O)c2cnc3[nH]ccc3c12)S(C)(=O)=O |r,wU:6.9,wD:3.2,(6.82,8.82,;5.28,8.86,;4.47,7.56,;5.2,6.2,;4.39,4.89,;5.12,3.53,;6.66,3.48,;7.47,4.79,;6.74,6.15,;7.38,2.13,;8.92,2.08,;9.65,.72,;11.19,.67,;12.55,1.4,;12.5,-.14,;8.84,-.59,;9.57,-1.94,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;6.57,.82,;4.56,10.22,;3.2,9.49,;3.83,11.58,;5.91,10.95,)|

BDBM255028

CCN1CN([C@H]2CC[C@H](CN(C)S(C)(=O)=O)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:5.4,wD:8.8,(11.92,-.68,;11.19,.67,;9.65,.72,;8.92,2.08,;7.38,2.13,;6.66,3.48,;5.12,3.53,;4.39,4.89,;5.2,6.2,;4.47,7.56,;5.28,8.86,;6.82,8.82,;4.56,10.22,;3.2,9.49,;3.83,11.58,;5.91,10.95,;6.74,6.15,;7.47,4.79,;6.57,.82,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;8.84,-.59,;9.57,-1.94,)|

BDBM255029

O=C1N(CN([C@H]2CC[C@H](CN3CCN(CCC#N)CC3)CC2)c2c1cnc1[nH]ccc21)C1CC1 |r,wU:5.4,wD:8.8,(9.57,-1.94,;8.84,-.59,;9.65,.72,;8.92,2.08,;7.38,2.13,;6.66,3.48,;5.12,3.53,;4.39,4.89,;5.2,6.2,;4.47,7.56,;5.28,8.86,;4.56,10.22,;5.37,11.53,;6.91,11.48,;7.72,12.79,;9.26,12.74,;10.07,14.05,;10.88,15.36,;7.63,10.13,;6.82,8.82,;6.74,6.15,;7.47,4.79,;6.57,.82,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;11.19,.67,;12.55,1.4,;12.5,-.14,)|

BDBM255030

CN1CN([C@H]2CC[C@H](CN3CCN(CCC#N)CC3)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:4.3,wD:7.7,(11.19,.67,;9.65,.72,;8.92,2.08,;7.38,2.13,;6.66,3.48,;5.12,3.53,;4.39,4.89,;5.2,6.2,;4.47,7.56,;5.28,8.86,;4.56,10.22,;5.37,11.53,;6.91,11.48,;7.72,12.79,;9.26,12.74,;10.07,14.05,;10.88,15.36,;7.63,10.13,;6.82,8.82,;6.74,6.15,;7.47,4.79,;6.57,.82,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;8.84,-.59,;9.57,-1.94,)|

BDBM254980

CN1CN([C@H]2CC[C@H](CNS(=O)(=O)CC(F)(F)F)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:4.3,wD:7.7,(-8,.87,;-6.67,.1,;-5.33,.87,;-4,.1,;-2.67,.87,;-2.67,2.41,;-1.33,3.18,;,2.41,;1.33,3.18,;2.67,2.41,;4,3.18,;4.77,4.52,;3.23,4.52,;2.63,3.88,;2.55,5.42,;2.47,6.96,;4.09,5.5,;1.01,5.34,;,.87,;-1.33,.1,;-4,-1.44,;-5.33,-2.21,;-5.33,-3.75,;-4,-4.52,;-2.67,-3.75,;-1.2,-4.22,;-.3,-2.98,;-1.2,-1.73,;-2.67,-2.21,;-6.67,-1.44,;-8,-2.21,)|

BDBM254981

CN1CN([C@H]2CC[C@H](CNS(C)(=O)=O)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:4.3,wD:7.7,(-6.67,.87,;-5.33,.1,;-4,.87,;-2.67,.1,;-1.33,.87,;-1.33,2.41,;,3.18,;1.33,2.41,;2.67,3.18,;4,2.41,;5.33,3.18,;6.67,2.41,;6.1,4.52,;4.56,4.52,;1.33,.87,;,.1,;-2.67,-1.44,;-4,-2.21,;-4,-3.75,;-2.67,-4.52,;-1.33,-3.75,;.13,-4.22,;1.04,-2.98,;.13,-1.73,;-1.33,-2.21,;-5.33,-1.44,;-6.67,-2.21,)|

BDBM254982

CN1CN([C@H]2CC[C@H](CN3CCCS3(=O)=O)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:4.3,wD:7.7,(-6.53,1.02,;-5.19,.25,;-3.86,1.02,;-2.53,.25,;-1.19,1.02,;-1.19,2.56,;.14,3.33,;1.47,2.56,;2.81,3.33,;4.14,2.56,;4.16,1.02,;5.62,.54,;6.53,1.79,;5.62,3.04,;6.39,4.37,;4.85,4.37,;1.47,1.02,;.14,.25,;-2.53,-1.29,;-3.86,-2.06,;-3.86,-3.6,;-2.53,-4.37,;-1.19,-3.6,;.27,-4.08,;1.18,-2.83,;.27,-1.58,;-1.19,-2.06,;-5.19,-1.29,;-6.53,-2.06,)|

BDBM254983

CN(C)C[C@H]1CC[C@@H](CC1)N1CNC(=O)c2cnc3[nH]ccc3c12 |r,wU:7.10,wD:4.3,(6,3.85,;4.67,3.08,;4.67,1.54,;3.33,3.85,;2,3.08,;.67,3.85,;-.67,3.08,;-.67,1.54,;.67,.77,;2,1.54,;-2,.77,;-3.33,1.54,;-4.67,.77,;-4.67,-.77,;-6,-1.54,;-3.33,-1.54,;-3.33,-3.08,;-2,-3.85,;-.67,-3.08,;.8,-3.56,;1.7,-2.31,;.8,-1.06,;-.67,-1.54,;-2,-.77,)|

BDBM254984

CN(C[C@H]1CC[C@@H](CC1)N1CN(C)C(=O)c2cnc3[nH]ccc3c12)CC(F)(F)F |r,wU:6.9,wD:3.2,(3.33,1.26,;3.33,2.8,;2,3.57,;.67,2.8,;-.67,3.57,;-2,2.8,;-2,1.26,;-.67,.49,;.67,1.26,;-3.33,.49,;-4.67,1.26,;-6,.49,;-7.34,1.26,;-6,-1.05,;-7.34,-1.82,;-4.67,-1.82,;-4.67,-3.36,;-3.33,-4.13,;-2,-3.36,;-.54,-3.84,;.37,-2.59,;-.54,-1.35,;-2,-1.82,;-3.33,-1.05,;4.67,3.57,;4.67,5.11,;4.67,6.65,;6.21,5.11,;3.13,5.11,)|

BDBM254985

COCN1CN([C@H]2CC[C@H](CN(C)CC(F)(F)F)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:6.5,wD:9.9,(-8.67,1.26,;-7.34,.49,;-6,1.26,;-4.67,.49,;-3.33,1.26,;-2,.49,;-.67,1.26,;-.67,2.8,;.67,3.57,;2,2.8,;3.33,3.57,;4.67,2.8,;4.67,1.26,;6,3.57,;7.34,2.8,;8.67,2.03,;6.57,1.46,;8.11,4.13,;2,1.26,;.67,.49,;-2,-1.05,;-3.33,-1.82,;-3.33,-3.36,;-2,-4.13,;-.67,-3.36,;.8,-3.84,;1.7,-2.59,;.8,-1.35,;-.67,-1.82,;-4.67,-1.05,;-6,-1.82,)|

BDBM254986

FC(F)(F)CNC[C@H]1CC[C@@H](CC1)N1CN(CC#N)C(=O)c2cnc3[nH]ccc3c12 |r,wU:10.13,wD:7.6,(7.34,-.28,;6,.49,;5.23,-.85,;6.77,1.82,;4.67,1.26,;4.67,2.8,;3.33,3.57,;2,2.8,;.67,3.57,;-.67,2.8,;-.67,1.26,;.67,.49,;2,1.26,;-2,.49,;-3.33,1.26,;-4.67,.49,;-6,1.26,;-7.34,.49,;-8.67,-.28,;-4.67,-1.05,;-6,-1.82,;-3.33,-1.82,;-3.33,-3.36,;-2,-4.13,;-.67,-3.36,;.8,-3.84,;1.7,-2.59,;.8,-1.35,;-.67,-1.82,;-2,-1.05,)|

BDBM254987

CS(=O)(=O)NC[C@H]1CC[C@@H](CC1)N1CN(C2CC2)C(=O)c2cnc3[nH]ccc3c12 |r,wU:9.12,wD:6.5,(7.44,2.41,;6.1,3.18,;6.87,4.52,;5.33,4.52,;4.77,2.41,;3.44,3.18,;2.1,2.41,;.77,3.18,;-.56,2.41,;-.56,.87,;.77,.1,;2.1,.87,;-1.9,.1,;-3.23,.87,;-4.56,.1,;-5.9,.87,;-6.67,2.21,;-7.44,.87,;-4.56,-1.44,;-5.9,-2.21,;-3.23,-2.21,;-3.23,-3.75,;-1.9,-4.52,;-.56,-3.75,;.9,-4.22,;1.81,-2.98,;.9,-1.73,;-.56,-2.21,;-1.9,-1.44,)|

BDBM254988

O=C1N(CN([C@H]2CC[C@H](CN3CCCS3(=O)=O)CC2)c2c1cnc1[nH]ccc21)C1CC1 |r,wU:5.4,wD:8.8,(-5.76,-2.06,;-4.42,-1.29,;-4.42,.25,;-3.09,1.02,;-1.76,.25,;-.42,1.02,;-.42,2.56,;.91,3.33,;2.24,2.56,;3.58,3.33,;4.91,2.56,;4.93,1.02,;6.39,.54,;7.3,1.79,;6.39,3.04,;7.16,4.37,;5.62,4.37,;2.24,1.02,;.91,.25,;-1.76,-1.29,;-3.09,-2.06,;-3.09,-3.6,;-1.76,-4.37,;-.42,-3.6,;1.04,-4.08,;1.95,-2.83,;1.04,-1.58,;-.42,-2.06,;-5.76,1.02,;-6.53,2.35,;-7.3,1.02,)|

BDBM254989

O=C1NCN([C@H]2CC[C@H](CNCC#N)CC2)c2c1cnc1[nH]ccc21 |r,wU:5.4,wD:8.8,(-7.34,-1.54,;-6,-.77,;-6,.77,;-4.67,1.54,;-3.33,.77,;-2,1.54,;-2,3.08,;-.67,3.85,;.67,3.08,;2,3.85,;3.33,3.08,;3.33,1.54,;4.67,.77,;6,,;.67,1.54,;-.67,.77,;-3.33,-.77,;-4.67,-1.54,;-4.67,-3.08,;-3.33,-3.85,;-2,-3.08,;-.54,-3.56,;.37,-2.31,;-.54,-1.06,;-2,-1.54,)|

BDBM254990

CCN1CN([C@H]2CC[C@H](CNS(=O)(=O)CC(F)(F)F)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:5.4,wD:8.8,(-8.67,.1,;-7.34,.87,;-6,.1,;-4.67,.87,;-3.33,.1,;-2,.87,;-2,2.41,;-.67,3.18,;.67,2.41,;2,3.18,;3.33,2.41,;4.67,3.18,;3.9,4.52,;5.44,4.52,;3.18,3.58,;2.78,5.07,;2.38,6.56,;4.27,5.47,;1.29,4.67,;.67,.87,;-.67,.1,;-3.33,-1.44,;-4.67,-2.21,;-4.67,-3.75,;-3.33,-4.52,;-2,-3.75,;-.54,-4.22,;.37,-2.98,;-.54,-1.73,;-2,-2.21,;-6,-1.44,;-7.34,-2.21,)|

BDBM254991

CCN1CN([C@H]2CC[C@H](CNS(=O)(=O)C3CC3)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:5.4,wD:8.8,(-8.11,.1,;-6.77,.87,;-5.44,.1,;-4.1,.87,;-2.77,.1,;-1.44,.87,;-1.44,2.41,;-.1,3.18,;1.23,2.41,;2.56,3.18,;3.9,2.41,;5.23,3.18,;4.46,4.52,;6,4.52,;6.57,2.41,;7.34,1.08,;8.11,2.41,;1.23,.87,;-.1,.1,;-2.77,-1.44,;-4.1,-2.21,;-4.1,-3.75,;-2.77,-4.52,;-1.44,-3.75,;.03,-4.22,;.93,-2.98,;.03,-1.73,;-1.44,-2.21,;-5.44,-1.44,;-6.77,-2.21,)|

BDBM254992

FC[C@H]1CC[C@@H](CC1)N1CN(CC#N)C(=O)c2cnc3[nH]ccc3c12 |r,wU:5.8,wD:2.1,(6.67,3.08,;5.33,3.85,;4,3.08,;2.67,3.85,;1.33,3.08,;1.33,1.54,;2.67,.77,;4,1.54,;,.77,;-1.33,1.54,;-2.67,.77,;-4,1.54,;-5.33,.77,;-6.67,,;-2.67,-.77,;-4,-1.54,;-1.33,-1.54,;-1.33,-3.08,;,-3.85,;1.33,-3.08,;2.8,-3.56,;3.7,-2.31,;2.8,-1.06,;1.33,-1.54,;,-.77,)|

BDBM254993

CCN1CN([C@H]2CC[C@H](CNS(C)(=O)=O)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:5.4,wD:8.8,(-7.34,.1,;-6,.87,;-4.67,.1,;-3.33,.87,;-2,.1,;-.67,.87,;-.67,2.41,;.67,3.18,;2,2.41,;3.33,3.18,;4.67,2.41,;6,3.18,;7.34,2.41,;5.23,4.52,;6.77,4.52,;2,.87,;.67,.1,;-2,-1.44,;-3.33,-2.21,;-3.33,-3.75,;-2,-4.52,;-.67,-3.75,;.8,-4.22,;1.7,-2.98,;.8,-1.73,;-.67,-2.21,;-4.67,-1.44,;-6,-2.21,)|

BDBM254994

CN(CC#N)C[C@H]1CC[C@@H](CC1)N1CN(CC(F)(F)F)C(=O)c2cnc3[nH]ccc3c12 |r,wU:9.12,wD:6.5,(4,1.54,;4,3.08,;5.33,3.85,;5.33,5.39,;5.33,6.93,;2.67,3.85,;1.33,3.08,;,3.85,;-1.33,3.08,;-1.33,1.54,;,.77,;1.33,1.54,;-2.67,.77,;-4,1.54,;-5.33,.77,;-6.67,1.54,;-8,.77,;-9.34,1.54,;-9.09,-.32,;-7.23,-.56,;-5.33,-.77,;-6.67,-1.54,;-4,-1.54,;-4,-3.08,;-2.67,-3.85,;-1.33,-3.08,;.13,-3.56,;1.04,-2.31,;.13,-1.06,;-1.33,-1.54,;-2.67,-.77,)|

BDBM254995

CN(C[C@H]1CC[C@@H](CC1)N1CN(CC#N)C(=O)c2cnc3[nH]ccc3c12)CC(F)(F)F |r,wU:6.9,wD:3.2,(4.67,1.26,;4.67,2.8,;3.33,3.57,;2,2.8,;.67,3.57,;-.67,2.8,;-.67,1.26,;.67,.49,;2,1.26,;-2,.49,;-3.33,1.26,;-4.67,.49,;-6,1.26,;-7.34,.49,;-8.67,-.28,;-4.67,-1.05,;-6,-1.82,;-3.33,-1.82,;-3.33,-3.36,;-2,-4.13,;-.67,-3.36,;.8,-3.84,;1.7,-2.59,;.8,-1.35,;-.67,-1.82,;-2,-1.05,;6,3.57,;7.34,2.8,;8.67,2.03,;8.11,4.13,;6.57,1.46,)|

BDBM255031

F[C@@H]1CCN(C[C@H]2CC[C@@H](CC2)N2CNC(=O)c3cnc4[nH]ccc4c23)C1 |wU:1.0,9.12,wD:6.5,(2.17,-9.21,;2.29,-7.67,;3.6,-6.86,;3.23,-5.36,;1.69,-5.25,;.88,-3.94,;1.61,-2.59,;3.15,-2.54,;3.88,-1.18,;3.07,.13,;1.53,.08,;.8,-1.28,;3.79,1.49,;5.33,1.53,;6.06,2.89,;5.25,4.2,;5.98,5.56,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,;2.98,2.79,;1.11,-6.68,)|

BDBM255032

CN1CN([C@H]2CC[C@H](COCCC#N)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:4.3,wD:7.7,(,-12.32,;,-10.78,;1.33,-10.01,;1.33,-8.47,;2.67,-7.7,;2.67,-6.16,;4,-5.39,;5.33,-6.16,;6.67,-5.39,;8,-6.16,;9.34,-5.39,;10.67,-6.16,;12,-5.39,;13.34,-4.62,;5.33,-7.7,;4,-8.47,;,-7.7,;-1.33,-8.47,;-2.67,-7.7,;-2.67,-6.16,;-1.33,-5.39,;-1.01,-3.88,;.52,-3.72,;1.14,-5.13,;,-6.16,;-1.33,-10.01,;-2.67,-10.78,)|

BDBM255033

CN1CN([C@H]2CC[C@H](CNC3(CC3)C#N)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:4.3,wD:7.7,(11.19,.67,;9.65,.72,;8.92,2.08,;7.38,2.13,;6.66,3.48,;5.12,3.53,;4.39,4.89,;5.2,6.2,;4.47,7.56,;5.28,8.86,;4.56,10.22,;4.34,11.75,;5.77,11.17,;3.09,9.74,;1.63,9.26,;6.74,6.15,;7.47,4.79,;6.57,.82,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;8.84,-.59,;9.57,-1.94,)|

BDBM255034

CN1CN([C@H]2CC[C@H](CNC3(CC3)C(F)(F)F)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:4.3,wD:7.7,(11.19,.67,;9.65,.72,;8.92,2.08,;7.38,2.13,;6.66,3.48,;5.12,3.53,;4.39,4.89,;5.2,6.2,;4.47,7.56,;5.28,8.86,;4.56,10.22,;4.34,11.75,;5.77,11.17,;3.09,9.74,;1.63,9.26,;2.61,11.2,;3.57,8.28,;6.74,6.15,;7.47,4.79,;6.57,.82,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;8.84,-.59,;9.57,-1.94,)|

BDBM255035

FC(F)CNC[C@H]1CC[C@@H](CC1)N1CN(C2CC2)C(=O)c2cnc3[nH]ccc3c12 |r,wU:9.12,wD:6.5,(4.64,12.89,;5.37,11.53,;6.91,11.48,;4.56,10.22,;5.28,8.86,;4.47,7.56,;5.2,6.2,;4.39,4.89,;5.12,3.53,;6.66,3.48,;7.47,4.79,;6.74,6.15,;7.38,2.13,;8.92,2.08,;9.65,.72,;11.19,.67,;12.55,1.4,;12.5,-.14,;8.84,-.59,;9.57,-1.94,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;6.57,.82,)|

BDBM255036

CCN1CN([C@H]2CC[C@H](CNCC(F)F)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:5.4,wD:8.8,(8.33,4.3,;7.6,2.94,;6.06,2.89,;5.33,1.53,;3.79,1.49,;3.07,.13,;3.88,-1.18,;3.15,-2.54,;1.61,-2.59,;.88,-3.94,;1.69,-5.25,;.97,-6.61,;1.78,-7.92,;1.05,-9.27,;3.32,-7.87,;.8,-1.28,;1.53,.08,;2.98,2.79,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,;5.25,4.2,;5.98,5.56,)|

BDBM255037

COCN1CN([C@H]2CC[C@H](CNCC(F)F)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:6.5,wD:9.9,(7.52,5.61,;8.33,4.3,;7.6,2.94,;6.06,2.89,;5.33,1.53,;3.79,1.49,;3.07,.13,;3.88,-1.18,;3.15,-2.54,;1.61,-2.59,;.88,-3.94,;1.69,-5.25,;.97,-6.61,;1.78,-7.92,;1.05,-9.27,;3.32,-7.87,;.8,-1.28,;1.53,.08,;2.98,2.79,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,;5.25,4.2,;5.98,5.56,)|

BDBM255038

FC(F)(F)C1(CC1)NC[C@H]1CC[C@@H](CC1)N1CN(CC#N)C(=O)c2cnc3[nH]ccc3c12 |r,wU:12.16,wD:9.9,(1.03,-7.25,;-.18,-6.3,;-1.13,-7.51,;.78,-5.09,;-1.39,-5.35,;-2.53,-6.37,;-2.85,-4.87,;-.66,-3.99,;.88,-3.94,;1.61,-2.59,;3.15,-2.54,;3.88,-1.18,;3.07,.13,;1.53,.08,;.8,-1.28,;3.79,1.49,;5.33,1.53,;6.06,2.89,;7.6,2.94,;8.33,4.3,;9.06,5.65,;5.25,4.2,;5.98,5.56,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,;2.98,2.79,)|

BDBM255039

FC(F)CNC[C@H]1CC[C@@H](CC1)N1CN(CC#N)C(=O)c2cnc3[nH]ccc3c12 |r,wU:9.12,wD:6.5,(1.05,-9.27,;1.78,-7.92,;3.32,-7.87,;.97,-6.61,;1.69,-5.25,;.88,-3.94,;1.61,-2.59,;3.15,-2.54,;3.88,-1.18,;3.07,.13,;1.53,.08,;.8,-1.28,;3.79,1.49,;5.33,1.53,;6.06,2.89,;7.6,2.94,;8.33,4.3,;9.06,5.65,;5.25,4.2,;5.98,5.56,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,;2.98,2.79,)|

BDBM255040

CN(CC#N)C[C@H]1CC[C@@H](CC1)N1CN(C2CC2)C(=O)c2cnc3[nH]ccc3c12 |r,wU:9.12,wD:6.5,(2.12,6.29,;2.93,7.6,;2.21,8.96,;.67,9.01,;-.87,9.06,;4.47,7.56,;5.2,6.2,;4.39,4.89,;5.12,3.53,;6.66,3.48,;7.47,4.79,;6.74,6.15,;7.38,2.13,;8.92,2.08,;9.65,.72,;11.19,.67,;12.55,1.4,;12.5,-.14,;8.84,-.59,;9.57,-1.94,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;6.57,.82,)|

BDBM255041

CCN1CN([C@H]2CC[C@H](CN(C)CC#N)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:5.4,wD:8.8,(11.92,-.68,;11.19,.67,;9.65,.72,;8.92,2.08,;7.38,2.13,;6.66,3.48,;5.12,3.53,;4.39,4.89,;5.2,6.2,;4.47,7.56,;2.93,7.6,;2.12,6.29,;2.21,8.96,;.67,9.01,;-.87,9.06,;6.74,6.15,;7.47,4.79,;6.57,.82,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;8.84,-.59,;9.57,-1.94,)|

BDBM255042

O=C1N(CC#N)CN([C@H]2CC[C@H](CNC3CC3)CC2)c2c1cnc1[nH]ccc21 |r,wU:8.7,wD:11.11,(5.98,5.56,;5.25,4.2,;6.06,2.89,;7.6,2.94,;8.33,4.3,;9.06,5.65,;5.33,1.53,;3.79,1.49,;3.07,.13,;3.88,-1.18,;3.15,-2.54,;1.61,-2.59,;.88,-3.94,;1.69,-5.25,;.97,-6.61,;1.01,-8.15,;-.34,-7.42,;.8,-1.28,;1.53,.08,;2.98,2.79,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,)|

BDBM255043

FC[C@H]1CC[C@@H](CC1)N1CN(C2CC2)C(=O)c2cnc3[nH]ccc3c12 |r,wU:5.8,wD:2.1,(2.93,7.6,;4.47,7.56,;5.2,6.2,;4.39,4.89,;5.12,3.53,;6.66,3.48,;7.47,4.79,;6.74,6.15,;7.38,2.13,;8.92,2.08,;9.65,.72,;11.19,.67,;12.55,1.4,;12.5,-.14,;8.84,-.59,;9.57,-1.94,;7.3,-.54,;6.49,-1.85,;4.95,-1.8,;4.22,-.44,;2.73,-.08,;2.61,1.46,;4.04,2.04,;5.03,.87,;6.57,.82,)|

BDBM255044

CN1CN([C@H]2CC[C@H](CN3CC(O)C3)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:4.3,wD:7.7,(7.6,2.94,;6.06,2.89,;5.33,1.53,;3.79,1.49,;3.07,.13,;3.88,-1.18,;3.15,-2.54,;1.61,-2.59,;.88,-3.94,;1.69,-5.25,;1.34,-6.75,;2.84,-7.1,;3.65,-8.41,;3.19,-5.6,;.8,-1.28,;1.53,.08,;2.98,2.79,;3.71,4.15,;2.9,5.46,;1.36,5.41,;.63,4.06,;-.86,3.69,;-.98,2.15,;.45,1.57,;1.44,2.75,;5.25,4.2,;5.98,5.56,)|

BDBM254996

CN(C[C@H]1CC[C@@H](CC1)N1CNC(=O)c2cnc3[nH]ccc3c12)CC(F)(F)F |r,wU:6.9,wD:3.2,(3.33,1.26,;3.33,2.8,;2,3.57,;.67,2.8,;-.67,3.57,;-2,2.8,;-2,1.26,;-.67,.49,;.67,1.26,;-3.33,.49,;-4.67,1.26,;-6,.49,;-6,-1.05,;-7.34,-1.82,;-4.67,-1.82,;-4.67,-3.36,;-3.33,-4.13,;-2,-3.36,;-.54,-3.84,;.37,-2.59,;-.54,-1.35,;-2,-1.82,;-3.33,-1.05,;4.67,3.57,;4.67,5.11,;4.67,6.65,;6.21,5.11,;3.13,5.11,)|

BDBM254997

FC(F)(F)CN1CN([C@H]2CC[C@H](CN3CCCS3(=O)=O)CC2)c2c(cnc3[nH]ccc23)C1=O |r,wU:8.7,wD:11.11,(-8.68,.66,;-7.19,.26,;-7.59,-1.23,;-5.86,-.51,;-5.86,1.03,;-4.52,.26,;-3.19,1.03,;-1.86,.26,;-.52,1.03,;-.52,2.57,;.81,3.34,;2.15,2.57,;3.48,3.34,;4.81,2.57,;4.81,1.03,;6.27,.54,;7.19,1.77,;6.27,3.03,;5.5,4.36,;7.04,4.36,;2.15,1.03,;.81,.26,;-1.86,-1.28,;-3.19,-2.05,;-3.19,-3.59,;-1.86,-4.36,;-.52,-3.59,;.94,-4.07,;1.85,-2.82,;.94,-1.58,;-.52,-2.05,;-4.52,-1.28,;-5.86,-2.05,)|

BDBM270855

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)c1ncnc2[nH]c(C)nc12 |r,wU:9.12,wD:6.5,(5.33,2.8,;4,2.03,;2.67,2.8,;3.44,4.13,;1.9,1.46,;1.33,3.57,;,2.8,;-1.33,3.57,;-2.67,2.8,;-2.67,1.26,;-1.33,.49,;,1.26,;-4,.49,;-5.33,1.26,;-4,-1.05,;-5.33,-1.82,;-5.33,-3.36,;-4,-4.13,;-2.67,-3.36,;-1.2,-3.84,;-.3,-2.59,;1.24,-2.59,;-1.2,-1.35,;-2.67,-1.82,)|

BDBM270856

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)c1ncnc2[nH]cnc12 |r,wU:9.12,wD:6.5,(5.33,2.8,;4,2.03,;2.67,2.8,;3.44,4.13,;1.9,1.46,;1.33,3.57,;,2.8,;-1.33,3.57,;-2.67,2.8,;-2.67,1.26,;-1.33,.49,;,1.26,;-4,.49,;-5.33,1.26,;-4,-1.05,;-5.33,-1.82,;-5.33,-3.36,;-4,-4.13,;-2.67,-3.36,;-1.2,-3.84,;-.3,-2.59,;-1.2,-1.35,;-2.67,-1.82,)|

BDBM270857

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)c1ncnc2[nH]ncc12 |r,wU:9.12,wD:6.5,(5.33,2.8,;4,2.03,;2.67,2.8,;3.44,4.13,;1.9,1.46,;1.33,3.57,;,2.8,;-1.33,3.57,;-2.67,2.8,;-2.67,1.26,;-1.33,.49,;,1.26,;-4,.49,;-5.33,1.26,;-4,-1.05,;-5.33,-1.82,;-5.33,-3.36,;-4,-4.13,;-2.67,-3.36,;-1.2,-3.84,;-.3,-2.59,;-1.2,-1.35,;-2.67,-1.82,)|

BDBM270858

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)c1ncnc2[nH]c(nc12)-c1ccccc1 |r,wU:9.12,wD:6.5,(5.33,2.8,;4,2.03,;2.67,2.8,;3.44,4.13,;1.9,1.46,;1.33,3.57,;,2.8,;-1.33,3.57,;-2.67,2.8,;-2.67,1.26,;-1.33,.49,;,1.26,;-4,.49,;-5.33,1.26,;-4,-1.05,;-5.33,-1.82,;-5.33,-3.36,;-4,-4.13,;-2.67,-3.36,;-1.2,-3.84,;-.3,-2.59,;-1.2,-1.35,;-2.67,-1.82,;1.24,-2.59,;2.01,-3.93,;3.55,-3.93,;4.32,-2.59,;3.55,-1.26,;2.01,-1.26,)|

BDBM270859

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)c1ncnc2[nH]c(Cc3ccccc3)nc12 |r,wU:9.12,wD:6.5,(5.33,4.03,;4,3.26,;2.67,4.03,;3.44,5.36,;1.9,2.69,;1.33,4.8,;,4.03,;-1.33,4.8,;-2.67,4.03,;-2.67,2.49,;-1.33,1.72,;,2.49,;-4,1.72,;-5.33,2.49,;-4,.18,;-5.33,-.59,;-5.33,-2.13,;-4,-2.9,;-2.67,-2.13,;-1.2,-2.61,;-.3,-1.36,;1.24,-1.36,;2.01,-2.69,;1.24,-4.03,;2.01,-5.36,;3.55,-5.36,;4.32,-4.03,;3.55,-2.69,;-1.2,-.12,;-2.67,-.59,)|

BDBM270860

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)Oc1ncnn2cccc12 |r,wU:6.5,wD:9.12,(5.33,2.8,;4,2.03,;2.67,2.8,;3.44,4.13,;1.9,1.46,;1.33,3.57,;,2.8,;,1.26,;-1.33,.49,;-2.67,1.26,;-2.67,2.8,;-1.33,3.57,;-4,.49,;-4,-1.05,;-5.33,-1.82,;-5.33,-3.36,;-4,-4.13,;-2.67,-3.36,;-1.2,-3.84,;-.3,-2.59,;-1.2,-1.35,;-2.67,-1.82,)|

BDBM270861

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)c1nc(N)ncc1Br |r,wU:9.12,wD:6.5,(6,2.8,;4.67,2.03,;3.33,2.8,;4.1,4.13,;2.56,1.46,;2,3.57,;.67,2.8,;-.67,3.57,;-2,2.8,;-2,1.26,;-.67,.49,;.67,1.26,;-3.33,.49,;-4.67,1.26,;-3.33,-1.05,;-2,-1.82,;-2,-3.36,;-.67,-4.13,;-3.33,-4.13,;-4.67,-3.36,;-4.67,-1.82,;-6,-1.05,)|

BDBM270862

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)Nc1ncnc2sccc12 |r,wU:9.12,wD:6.5,(5.33,2.8,;4,2.03,;2.67,2.8,;3.44,4.13,;1.9,1.46,;1.33,3.57,;,2.8,;-1.33,3.57,;-2.67,2.8,;-2.67,1.26,;-1.33,.49,;,1.26,;-4,.49,;-4,-1.05,;-5.33,-1.82,;-5.33,-3.36,;-4,-4.13,;-2.67,-3.36,;-1.2,-3.84,;-.3,-2.59,;-1.2,-1.35,;-2.67,-1.82,)|

BDBM270863

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)c1ncnc2sccc12 |r,wU:9.12,wD:6.5,(5.33,2.8,;4,2.03,;2.67,2.8,;3.44,4.13,;1.9,1.46,;1.33,3.57,;,2.8,;-1.33,3.57,;-2.67,2.8,;-2.67,1.26,;-1.33,.49,;,1.26,;-4,.49,;-5.33,1.26,;-4,-1.05,;-5.33,-1.82,;-5.33,-3.36,;-4,-4.13,;-2.67,-3.36,;-1.2,-3.84,;-.3,-2.59,;-1.2,-1.35,;-2.67,-1.82,)|

BDBM270864

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)c1cc(Cl)nc(N)n1 |r,wU:9.12,wD:6.5,(6,2.8,;4.67,2.03,;3.33,2.8,;4.1,4.13,;2.56,1.46,;2,3.57,;.67,2.8,;-.67,3.57,;-2,2.8,;-2,1.26,;-.67,.49,;.67,1.26,;-3.33,.49,;-4.67,1.26,;-3.33,-1.05,;-4.67,-1.82,;-4.67,-3.36,;-6,-4.13,;-3.33,-4.13,;-2,-3.36,;-.67,-4.13,;-2,-1.82,)|

BDBM270865

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)Nc1ccnc(N)n1 |r,wU:9.12,wD:6.5,(5.33,2.8,;4,2.03,;2.67,2.8,;3.44,4.13,;1.9,1.46,;1.33,3.57,;,2.8,;-1.33,3.57,;-2.67,2.8,;-2.67,1.26,;-1.33,.49,;,1.26,;-4,.49,;-4,-1.05,;-5.33,-1.82,;-5.33,-3.36,;-4,-4.13,;-2.67,-3.36,;-1.33,-4.13,;-2.67,-1.82,)|

BDBM270866

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)Nc1nc(N)ncc1C |r,wU:9.12,wD:6.5,(6,2.8,;4.67,2.03,;3.33,2.8,;4.1,4.13,;2.56,1.46,;2,3.57,;.67,2.8,;-.67,3.57,;-2,2.8,;-2,1.26,;-.67,.49,;.67,1.26,;-3.33,.49,;-3.33,-1.05,;-2,-1.82,;-2,-3.36,;-.67,-4.13,;-3.33,-4.13,;-4.67,-3.36,;-4.67,-1.82,;-6,-1.05,)|

BDBM270867

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)Nc1nc(N)ncc1Br |r,wU:9.12,wD:6.5,(6,2.8,;4.67,2.03,;3.33,2.8,;4.1,4.13,;2.56,1.46,;2,3.57,;.67,2.8,;-.67,3.57,;-2,2.8,;-2,1.26,;-.67,.49,;.67,1.26,;-3.33,.49,;-3.33,-1.05,;-2,-1.82,;-2,-3.36,;-.67,-4.13,;-3.33,-4.13,;-4.67,-3.36,;-4.67,-1.82,;-6,-1.05,)|

BDBM270868

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)Nc1c(cnc2sccc12)C#N |r,wU:9.12,wD:6.5,(6.67,2.8,;5.33,2.03,;4,2.8,;4.77,4.13,;3.23,1.46,;2.67,3.57,;1.33,2.8,;,3.57,;-1.33,2.8,;-1.33,1.26,;,.49,;1.33,1.26,;-2.67,.49,;-2.67,-1.05,;-4,-1.82,;-4,-3.36,;-2.67,-4.13,;-1.33,-3.36,;.13,-3.84,;1.04,-2.59,;.13,-1.35,;-1.33,-1.82,;-5.33,-1.05,;-6.67,-.28,)|

BDBM270869

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)Nc1ncnn2cccc12 |r,wU:9.12,wD:6.5,(5.33,2.8,;4,2.03,;2.67,2.8,;3.44,4.13,;1.9,1.46,;1.33,3.57,;,2.8,;-1.33,3.57,;-2.67,2.8,;-2.67,1.26,;-1.33,.49,;,1.26,;-4,.49,;-4,-1.05,;-5.33,-1.82,;-5.33,-3.36,;-4,-4.13,;-2.67,-3.36,;-1.2,-3.84,;-.3,-2.59,;-1.2,-1.35,;-2.67,-1.82,)|

BDBM270870

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)c1ccnc(N)n1 |r,wU:9.12,wD:6.5,(5.33,2.8,;4,2.03,;2.67,2.8,;3.44,4.13,;1.9,1.46,;1.33,3.57,;,2.8,;-1.33,3.57,;-2.67,2.8,;-2.67,1.26,;-1.33,.49,;,1.26,;-4,.49,;-5.33,1.26,;-4,-1.05,;-5.33,-1.82,;-5.33,-3.36,;-4,-4.13,;-2.67,-3.36,;-1.33,-4.13,;-2.67,-1.82,)|

BDBM270871

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)c1c(cnc2sccc12)C#N |r,wU:9.12,wD:6.5,(6.67,2.8,;5.33,2.03,;4,2.8,;4.77,4.13,;3.23,1.46,;2.67,3.57,;1.33,2.8,;,3.57,;-1.33,2.8,;-1.33,1.26,;,.49,;1.33,1.26,;-2.67,.49,;-4,1.26,;-2.67,-1.05,;-4,-1.82,;-4,-3.36,;-2.67,-4.13,;-1.33,-3.36,;.13,-3.84,;1.04,-2.59,;.13,-1.35,;-1.33,-1.82,;-5.33,-1.05,;-6.67,-.28,)|

BDBM270872

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)c1c(cnc2[nH]ccc12)[N+]([O-])=O |r,wU:9.12,wD:6.5,(6.67,2.8,;5.33,2.03,;4,2.8,;4.77,4.13,;3.23,1.46,;2.67,3.57,;1.33,2.8,;,3.57,;-1.33,2.8,;-1.33,1.26,;,.49,;1.33,1.26,;-2.67,.49,;-4,1.26,;-2.67,-1.05,;-4,-1.82,;-4,-3.36,;-2.67,-4.13,;-1.33,-3.36,;.13,-3.84,;1.04,-2.59,;.13,-1.35,;-1.33,-1.82,;-5.33,-1.05,;-5.33,.49,;-6.67,-1.82,)|

BDBM270873

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)Oc1ncnc2sccc12 |r,wU:6.5,wD:9.12,(5.33,2.8,;4,2.03,;2.67,2.8,;3.44,4.13,;1.9,1.46,;1.33,3.57,;,2.8,;,1.26,;-1.33,.49,;-2.67,1.26,;-2.67,2.8,;-1.33,3.57,;-4,.49,;-4,-1.05,;-5.33,-1.82,;-5.33,-3.36,;-4,-4.13,;-2.67,-3.36,;-1.2,-3.84,;-.3,-2.59,;-1.2,-1.35,;-2.67,-1.82,)|

BDBM270874

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)Oc1c(cnc2sccc12)C#N |r,wU:6.5,wD:9.12,(6,2.8,;4.67,2.03,;3.33,2.8,;4.1,4.13,;2.56,1.46,;2,3.57,;.67,2.8,;.67,1.26,;-.67,.49,;-2,1.26,;-2,2.8,;-.67,3.57,;-3.33,.49,;-3.33,-1.05,;-4.67,-1.82,;-4.67,-3.36,;-3.33,-4.13,;-2,-3.36,;-.54,-3.84,;.37,-2.59,;-.54,-1.35,;-2,-1.82,;-6,-1.05,;-6,.49,)|

BDBM270875

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)c1nc(N)ncc1-c1ccccc1 |r,wU:9.12,wD:6.5,(7.34,2.8,;6,2.03,;4.67,2.8,;5.44,4.13,;3.9,1.46,;3.33,3.57,;2,2.8,;.67,3.57,;-.67,2.8,;-.67,1.26,;.67,.49,;2,1.26,;-2,.49,;-3.33,1.26,;-2,-1.05,;-.67,-1.82,;-.67,-3.36,;.67,-4.13,;-2,-4.13,;-3.33,-3.36,;-3.33,-1.82,;-4.67,-1.05,;-4.67,.49,;-6,1.26,;-7.34,.49,;-7.34,-1.05,;-6,-1.82,)|

BDBM270876

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)n1cnc2cnc3[nH]ccc3c12 |r,wU:9.12,wD:6.5,(5.75,2.78,;4.41,2.01,;3.08,2.78,;3.85,4.12,;2.31,1.45,;1.75,3.55,;.41,2.78,;-.92,3.55,;-2.26,2.78,;-2.26,1.24,;-.92,.47,;.41,1.24,;-3.59,.47,;-5.12,.63,;-5.75,-.77,;-4.6,-1.81,;-4.6,-3.35,;-3.27,-4.12,;-1.93,-3.35,;-.47,-3.82,;.43,-2.58,;-.47,-1.33,;-1.93,-1.81,;-3.27,-1.04,)|

BDBM270877

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)Nc1nc(N)ncc1-c1ccccc1 |r,wU:9.12,wD:6.5,(7.34,2.8,;6,2.03,;4.67,2.8,;5.44,4.13,;3.9,1.46,;3.33,3.57,;2,2.8,;.67,3.57,;-.67,2.8,;-.67,1.26,;.67,.49,;2,1.26,;-2,.49,;-2,-1.05,;-.67,-1.82,;-.67,-3.36,;.67,-4.13,;-2,-4.13,;-3.33,-3.36,;-3.33,-1.82,;-4.67,-1.05,;-4.67,.49,;-6,1.26,;-7.34,.49,;-7.34,-1.05,;-6,-1.82,)|

BDBM270878

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)c1c(cnn2cccc12)C#N |r,wU:9.12,wD:6.5,(6.67,2.8,;5.33,2.03,;4,2.8,;4.77,4.13,;3.23,1.46,;2.67,3.57,;1.33,2.8,;,3.57,;-1.33,2.8,;-1.33,1.26,;,.49,;1.33,1.26,;-2.67,.49,;-4,1.26,;-2.67,-1.05,;-4,-1.82,;-4,-3.36,;-2.67,-4.13,;-1.33,-3.36,;.13,-3.84,;1.04,-2.59,;.13,-1.35,;-1.33,-1.82,;-5.33,-1.05,;-6.67,-.28,)|

BDBM270879

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)Oc1c(cnc2[nH]ccc12)[N+]([O-])=O |r,wU:6.5,wD:9.12,(6.67,2.8,;5.33,2.03,;4,2.8,;4.77,4.13,;3.23,1.46,;2.67,3.57,;1.33,2.8,;1.33,1.26,;,.49,;-1.33,1.26,;-1.33,2.8,;,3.57,;-2.67,.49,;-2.67,-1.05,;-4,-1.82,;-4,-3.36,;-2.67,-4.13,;-1.33,-3.36,;.13,-3.84,;1.04,-2.59,;.13,-1.35,;-1.33,-1.82,;-5.33,-1.05,;-5.33,.49,;-6.67,-1.82,)|

BDBM270880

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)c1c(cnc2[nH]ccc12)C#N |r,wU:9.12,wD:6.5,(6.67,2.8,;5.33,2.03,;4,2.8,;4.77,4.13,;3.23,1.46,;2.67,3.57,;1.33,2.8,;,3.57,;-1.33,2.8,;-1.33,1.26,;,.49,;1.33,1.26,;-2.67,.49,;-4,1.26,;-2.67,-1.05,;-4,-1.82,;-4,-3.36,;-2.67,-4.13,;-1.33,-3.36,;.13,-3.84,;1.04,-2.59,;.13,-1.35,;-1.33,-1.82,;-5.33,-1.05,;-6.67,-.28,)|

BDBM270881

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)Nc1c(cnn2cccc12)C#N |r,wU:9.12,wD:6.5,(6.67,2.8,;5.33,2.03,;4,2.8,;4.77,4.13,;3.23,1.46,;2.67,3.57,;1.33,2.8,;,3.57,;-1.33,2.8,;-1.33,1.26,;,.49,;1.33,1.26,;-2.67,.49,;-2.67,-1.05,;-4,-1.82,;-4,-3.36,;-2.67,-4.13,;-1.33,-3.36,;.13,-3.84,;1.04,-2.59,;.13,-1.35,;-1.33,-1.82,;-5.33,-1.05,;-6.67,-.28,)|

BDBM270882

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)c1ncnn2cccc12 |r,wU:9.12,wD:6.5,(5.33,2.8,;4,2.03,;2.67,2.8,;3.44,4.13,;1.9,1.46,;1.33,3.57,;,2.8,;-1.33,3.57,;-2.67,2.8,;-2.67,1.26,;-1.33,.49,;,1.26,;-4,.49,;-5.33,1.26,;-4,-1.05,;-5.33,-1.82,;-5.33,-3.36,;-4,-4.13,;-2.67,-3.36,;-1.2,-3.84,;-.3,-2.59,;-1.2,-1.35,;-2.67,-1.82,)|

BDBM274974

CC1(C)CCC(CC1)c1nnn2cnc3[nH]ccc3c12

BDBM275148

C(N1CCC(CC1)c1nnn2cnc3[nH]ccc3c12)c1nc2ccccc2s1

BDBM275280

O=S(=O)(C[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12)c1ccccc1 |r,wU:7.10,wD:4.3,(1.78,.91,;2.18,2.4,;3.27,1.31,;.69,2.8,;-.4,1.71,;-1.89,2.11,;-2.97,1.02,;-2.58,-.47,;-1.09,-.87,;0,.22,;-3.67,-1.56,;-5.2,-1.4,;-5.82,-2.8,;-4.68,-3.83,;-4.68,-5.37,;-3.35,-6.14,;-2.01,-5.37,;-.55,-5.85,;.36,-4.6,;-.55,-3.36,;-2.01,-3.83,;-3.35,-3.06,;3.27,3.55,;4.77,3.19,;5.82,4.31,;5.38,5.79,;3.89,6.14,;2.83,5.03,)|

BDBM275285

[N-]=[N+]=NC[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:7.10,wD:4.3,(5.09,5.39,;4,4.3,;2.91,3.15,;1.42,3.55,;.34,2.46,;-1.15,2.86,;-2.24,1.77,;-1.84,.28,;-.36,-.12,;.73,.97,;-2.93,-.81,;-4.46,-.64,;-5.09,-2.05,;-3.95,-3.08,;-3.95,-4.62,;-2.61,-5.39,;-1.28,-4.62,;.19,-5.1,;1.09,-3.85,;.19,-2.61,;-1.28,-3.08,;-2.61,-2.31,)|

BDBM275349

O\N=C\[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:6.9,wD:3.2,(4.55,4.82,;3.46,3.73,;1.97,4.13,;.88,3.04,;-.61,3.44,;-1.7,2.35,;-1.3,.86,;.19,.46,;1.28,1.55,;-2.39,-.23,;-3.92,-.07,;-4.55,-1.48,;-3.4,-2.51,;-3.4,-4.05,;-2.07,-4.82,;-.73,-4.05,;.73,-4.52,;1.64,-3.28,;.73,-2.03,;-.73,-2.51,;-2.07,-1.74,)|

BDBM275370

C[C@@H]1CCN(Cc2cccc(F)c2F)C[C@@H]1n1ccc(=O)c2cnc3[nH]ccc3c12 |r|

BDBM275371

C[C@@H]1CCN(C)C[C@@H]1n1ccc(=O)c2cnc3[nH]ccc3c12 |r|

BDBM275377

OC(=O)[C@H]1CC[C@@H](CC1)c1nnn2cnc3[nH]ccc3c12 |r,wU:6.9,wD:3.2,(4,3.33,;2.51,3.73,;2.11,5.21,;1.42,2.64,;-.06,3.04,;-1.15,1.95,;-.75,.46,;.73,.06,;1.82,1.15,;-1.84,-.63,;-3.37,-.47,;-4,-1.87,;-2.86,-2.9,;-2.86,-4.44,;-1.52,-5.21,;-.19,-4.44,;1.28,-4.92,;2.18,-3.67,;1.28,-2.43,;-.19,-2.9,;-1.52,-2.13,)|

BDBM275379

O=c1[nH]c(=O)c2cnc3[nH]ccc3c2n1[C@H]1CC[C@H](CCC#N)CC1 |r,wU:18.21,wD:15.17,(-4,2.69,;-4,1.15,;-5.33,.38,;-5.33,-1.15,;-6.67,-1.93,;-4,-1.93,;-4,-3.47,;-2.67,-4.23,;-1.33,-3.47,;.13,-3.94,;1.04,-2.69,;.13,-1.45,;-1.33,-1.93,;-2.67,-1.15,;-2.67,.38,;-1.33,1.15,;,.38,;1.33,1.15,;1.33,2.69,;2.67,3.47,;4,2.69,;5.33,3.47,;6.67,4.23,;,3.47,;-1.33,2.69,)|

BDBM275380

FC(F)(F)CN(C[C@H]1CC[C@@H](CC1)n1c2c3cc[nH]c3ncc2c(=O)[nH]c1=O)C(=O)CC#N |r,wU:10.13,wD:7.6,(7.34,3.85,;6,3.08,;6,1.54,;7.34,2.31,;4.67,3.85,;3.33,3.08,;2,3.85,;.67,3.08,;-.67,3.85,;-2,3.08,;-2,1.54,;-.67,.77,;.67,1.54,;-3.33,.77,;-3.33,-.77,;-2,-1.54,;-.54,-1.06,;.37,-2.31,;-.54,-3.56,;-2,-3.08,;-3.33,-3.85,;-4.67,-3.08,;-4.67,-1.54,;-6,-.77,;-7.34,-1.54,;-6,.77,;-4.67,1.54,;-4.67,3.08,;3.33,1.54,;2,.77,;4.67,.77,;4.67,-.77,;4.67,-2.31,)|

BDBM275381

CN(C[C@H]1CC[C@@H](CC1)n1c2c3cc[nH]c3ncc2c(=O)[nH]c1=O)CC(F)(F)F |r,wU:6.9,wD:3.2,(3.33,1.54,;3.33,3.08,;2,3.85,;.67,3.08,;-.67,3.85,;-2,3.08,;-2,1.54,;-.67,.77,;.67,1.54,;-3.33,.77,;-3.33,-.77,;-2,-1.54,;-.54,-1.06,;.37,-2.31,;-.54,-3.56,;-2,-3.08,;-3.33,-3.85,;-4.67,-3.08,;-4.67,-1.54,;-6,-.77,;-7.34,-1.54,;-6,.77,;-4.67,1.54,;-4.67,3.08,;4.67,3.85,;6,3.08,;7.34,3.85,;6,1.54,;7.34,2.31,)|

BDBM277394

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)C(F)F)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277408

COC(=O)CCN1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:5:6:9.8:12.11.13|

BDBM277435

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC3CCC(=O)O3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277460

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4Cc3ccc(nc3)C#N)n2)n[nH]1 |r,TLB:24:23:15.22.16:18.20.19|

BDBM277466

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CF)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM277470

CCC(SC)C(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:5:7:10.9:13.12.14|

BDBM277486

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)C(C)(C)CCO)n2)n[nH]1 |r,TLB:24:23:15.22.16:20.18.19|

BDBM277505

CCCCOC(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:5:7:14.13.15:11.9.10|

BDBM277508

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)OCc3ccco3)n2)n[nH]1 |r,TLB:24:23:15.22.16:20.18.19|

BDBM277509

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)OCCC#N)n2)n[nH]1 |r,TLB:24:23:15.22.16:20.18.19|

BDBM277534

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)c3ccc(C)nc3)n2)n[nH]1 |r,TLB:24:23:20.19.18:15.22.16|

BDBM277537

CCCC1CCCN1S(=O)(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:8:11:15.14.13:18.17.19|

BDBM277549

Cc1cc(Nc2cc3nc(CO)ccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC#N)n2)n[nH]1 |r,TLB:25:24:21.20:17.23.18|

BDBM277551

CCS(=O)(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2nc(COO)ccc12 |r,TLB:2:5:8.7:11.10.12|

BDBM277552

Cc1cc(Nc2cc3nc(CCO)ccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCCF)n2)n[nH]1 |r,TLB:26:25:22.21:18.24.19|

BDBM277565

Cc1cc(Nc2cc3nc(CN4CCOCC4)ccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)c3cccnc3)n2)n[nH]1 |r,TLB:31:30:27.26.25:22.29.23|

BDBM277566

Cc1cc(Nc2cc3nc(CN4CCOCC4)ccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)N3CCC3)n2)n[nH]1 |r,TLB:31:30:27.26.25:22.29.23|

BDBM277571

Cc1cc(Nc2cc3nc(CN4CCC(F)(F)CC4)ccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC(F)(F)F)n2)n[nH]1 |r,TLB:32:31:28.27:24.30.25|

BDBM277572

CC(C)CN1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2nc(CN3CCC(F)(F)CC3)ccc12 |r,TLB:3:4:7.6:10.9.11|

BDBM277573

CN1CCN(Cc2ccc3c(N[C@H]4C[C@@H]5CC[C@H](C4)N5CC(F)(F)F)nc(Nc4cc(C)[nH]n4)cc3n2)CC1 |r,TLB:20:19:16.15:12.18.13|

BDBM277580

Cc1cc(Nc2cc3nc(CS(C)(=O)=O)ccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCCF)n2)n[nH]1 |r,TLB:28:27:24.23:20.26.21|

BDBM277581

Cc1cc(Nc2cc3nc(CS(C)(=O)=O)ccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCC(F)(F)F)n2)n[nH]1 |r,TLB:28:27:24.23:20.26.21|

BDBM277583

Cc1cc(Nc2cc3ncc(C)cc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4Cc3ccncc3)n2)n[nH]1 |r,TLB:24:23:20.19:16.22.17|

BDBM277605

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4Cc3ccncc3)c2c1 |r,TLB:26:25:22.21:18.24.19|

BDBM277606

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)OC(C)C)c2c1 |r,TLB:26:25:22.21:18.24.19|

BDBM277608

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)OC(C)SO)c2c1 |r,TLB:27:26:23.22.21:18.25.19|

BDBM277618

COC(=O)c1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CC(F)F)c2c1 |r,TLB:28:27:24.23:20.26.21|

BDBM277619

COC(=O)c1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)C(C)C(O)=S)c2c1 |r,TLB:28:27:24.23:20.26.21|

BDBM277634

CCC(SC)C(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncc(cc12)S(C)(=O)=O |r,TLB:5:7:10.9:13.12.14|

BDBM277651

COc1ccnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4C3(COC3)C#N)c12 |r,TLB:27:26:23.22:19.25.20|

BDBM277657

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4Cc3ccncc3)c3cccnc3c2F)n[nH]1 |r,TLB:17:16:13.12:9.15.10|

BDBM277660

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CC#N)c3cccnc3c2F)n[nH]1 |r,TLB:18:17:9.16.10:12.14.13|

BDBM277662

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4S(=O)(=O)c3cccnc3)c3cccnc3c2F)n[nH]1 |r,TLB:18:17:9.16.10:12.14.13|

BDBM277666

CN(C)CC(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)c(F)c2ncccc12 |r,TLB:4:6:13.12.14:8.10.9|

BDBM279809

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CC[C@H](C1)N2S(=O)(=O)N1CC(C1)C#N |r,TLB:26:25:22.21:18.24.19|

BDBM279810

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2S(=O)(=O)N1CC(C1)C#N |r,TLB:27:26:23.22.21:18.25.19|

BDBM279811

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2S(C)(=O)=O |r,TLB:27:26:23.22.21:18.25.19|

BDBM279812

COCCS(=O)(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)N(C)c1nc(Nc2cc(CO)[nH]n2)cc(OC)n1 |r,TLB:4:7:11.10.9:14.13.15|

BDBM279813

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CC[C@H](C1)N2CCC#N |r,TLB:26:25:22.21:18.24.19|

BDBM279815

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2Cc1cncc(c1)C#N |r,TLB:27:26:23.22.21:18.25.19|

BDBM279816

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2C(=O)OCC(C)C |r,TLB:27:26:23.22.21:18.25.19|

BDBM279817

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)C1C[C@@H]2CCC[C@H](C1)N2C(=O)C(F)F |r,TLB:27:26:23.22.21:18.25.19|

BDBM279829

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2S(=O)(=O)CCC#N |r,TLB:27:26:23.22.21:18.25.19|

BDBM279830

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2S(=O)(=O)N1CCCC1 |r,TLB:27:26:23.22.21:18.25.19|

BDBM279831

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2S(=O)(=O)C1CC1 |r,TLB:27:26:23.22.21:18.25.19|

BDBM279832

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2S(=O)(=O)c1cccnc1 |r,TLB:27:26:23.22.21:18.25.19|

BDBM279833

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2S(=O)(=O)c1ccccc1 |r,TLB:27:26:23.22.21:18.25.19|

BDBM279834

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2S(=O)(=O)N1CCC1 |r,TLB:27:26:23.22.21:18.25.19|

BDBM279841

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2CCC#N |r,TLB:27:26:23.22.21:18.25.19|

BDBM279842

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2CC1(CC1)C#N |r,TLB:27:26:23.22.21:18.25.19|

BDBM279847

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2C(=O)CC(C)C |r,TLB:27:26:23.22.21:18.25.19|

BDBM279848

COC(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)N(C)c1nc(Nc2cc(CO)[nH]n2)cc(OC)n1 |r,TLB:2:4:8.7.6:11.10.12|

BDBM279849

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2C(=O)N1CCOCC1 |r,TLB:27:26:23.22.21:18.25.19|

BDBM279850

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2C(=O)CC1CC1 |r,TLB:27:26:23.22.21:18.25.19|

BDBM279851

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2C(C)=O |r,TLB:27:26:23.22.21:18.25.19|

BDBM279852

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2C(=O)C1CCCC1 |r,TLB:27:26:23.22.21:18.25.19|

BDBM279853

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2C(=O)C1CCC1 |r,TLB:27:26:23.22.21:18.25.19|

BDBM281307

CCc1cc(O)ccc1-c1cc2[nH]ncc2c(NCc2ccccc2N(C)SC)n1

BDBM281308

CCc1cc(O)ccc1-c1cc2[nH]ncc2c(n1)N1CCC(C1)S(=O)(=O)N(C)C

BDBM281309

CCc1cc(O)ccc1-c1cc2[nH]ncc2c(NCc2c(C)cccc2N(C)S(C)=O)n1

BDBM281310

CCc1cc(O)c(F)cc1-c1cc2[nH]ncc2c(NCc2ccccc2N(C)S(C)(=O)=O)n1

BDBM281311

CCc1cc(O)ccc1-c1cc2[nH]ncc2c(NCCc2ccc(cc2)-c2ccccc2)n1

BDBM281312

CCc1cc(O)ccc1-c1cc2[nH]ncc2c(n1)N1CCc2c(C1)cccc2NSC

BDBM281313

CCc1cc(O)ccc1-c1cc2[nH]ncc2c(n1)N1CCC(CC1)OC

BDBM281314

CCc1cc(O)c(F)cc1-c1cc2[nH]ncc2c(NCc2cc(C)ccc2N(C)S(C)(=O)=O)n1

BDBM281315

CCc1cc(O)ccc1-c1cc2[nH]ncc2c(n1)N1CCc2ccc(OC)c(OC)c2C1

BDBM281316

CCc1cc(O)ccc1-c1cc2[nH]ncc2c(n1)N1CC(C1)Oc1ccccc1

BDBM281317

CCc1cc(O)ccc1-c1cc2[nH]ncc2c(n1)N1CCc2cc(ccc2C1)-n1cnc(C)c1

BDBM281318

CCc1cc(O)ccc1-c1cc2[nH]ncc2c(n1)N1CCc2cc(OCCOC)ccc2C1

BDBM281319

CCc1cc(O)ccc1-c1cc2[nH]ncc2c(n1)N1CC(C)(O)C1

BDBM281320

CCc1cc(O)ccc1-c1cc2[nH]ncc2c(n1)N1CCc2ccc(cc2C1)S(=O)(=O)NCCN1CCCC1

BDBM281321

CCc1cc(O)ccc1-c1cc2[nH]ncc2c(n1)N1CCc2c(C1)cccc2C(=O)NCc1ccccc1

BDBM281322

CCc1cc(O)ccc1-c1cc2[nH]ncc2c(n1)N1CCc2cc(OC)c(OCc3ccccc3)cc2C1

BDBM281323

CCc1cc(O)ccc1-c1cc2[nH]ncc2c(n1)N1CCc2c(Cl)cccc2C1

BDBM281324

CCc1cc(O)ccc1-c1cc2[nH]ncc2c(n1)N1CC(C1)Oc1cc(ccc1Cl)C#N

BDBM281325

CCc1cc(O)ccc1-c1cc2[nH]ncc2c(n1)N1CCc2cc(F)ccc2C1

BDBM281326

CCc1cc(O)ccc1-c1cc2[nH]ncc2c(n1)N1CCc2cccc(OC)c2C1

BDBM281327

CCCN(c1ccccc1CNc1nc(cc2[nH]ncc12)-c1cc(F)c(O)cc1CC)S(C)(=O)=O

BDBM281328

CCN(c1ccccc1CNc1nc(cc2[nH]ncc12)-c1cc(F)c(O)cc1CC)S(C)(=O)=O

BDBM281329

CCCCN(c1ccccc1CNc1nc(cc2[nH]ncc12)-c1cc(F)c(O)cc1CC)S(C)(=O)=O

BDBM281330

CCc1cc(O)c(F)cc1-c1cc2[nH]ncc2c(NCc2cc(Cl)ccc2N(C)S(C)(=O)=O)n1

BDBM281331

CCc1cc(O)c(F)cc1-c1cc2[nH]ncc2c(NCc2ccccc2N(C)S(=O)(=O)CC)n1

BDBM281332

CCN(c1ccccc1CN(C)c1nc(cc2[nH]ncc12)-c1cc(F)c(O)cc1CC)S(C)(=O)=O

BDBM281333

CCCCN(c1ccccc1CN(C)c1nc(cc2[nH]ncc12)-c1cc(F)c(O)cc1CC)S(C)(=O)=O

BDBM281334

CCc1cc(O)c(F)cc1-c1cc2[nH]ncc2c(n1)N(CCN1CCOCC1)Cc1ccccc1N(C)S(C)(=O)=O

BDBM281335

CCc1cc(O)c(F)cc1-c1cc2[nH]ncc2c(NCc2ccccc2N(CCO)S(C)(=O)=O)n1

BDBM281336

CCN(c1ccc(C)cc1CN(C)c1nc(cc2[nH]ncc12)-c1cc(F)c(O)cc1CC)S(C)(=O)=O

BDBM281337

CCN(Cc1cc(C)ccc1N(C)S(C)(=O)=O)c1nc(cc2[nH]ncc12)-c1cc(F)c(O)cc1CC

BDBM281338

CCCN(Cc1cc(C)ccc1N(C)S(C)(=O)=O)c1nc(cc2[nH]ncc12)-c1cc(F)c(O)cc1CC

BDBM281339

CCc1cc(O)c(F)cc1-c1cc2[nH]ncc2c(n1)N(C)Cc1ccccc1N(C)S(C)(=O)=O

BDBM281340

CN(c1ccccc1CNc1nc(cc2[nH]ncc12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281341

CN(Cc1ccccc1N(C)S(C)(=O)=O)c1nc(cc2[nH]ncc12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281342

CN(c1ccc(C)cc1CNc1nc(cc2[nH]ncc12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281343

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(C(=O)NC)c2c(NCc2ccccc2N(C)S(C)(=O)=O)n1

BDBM281344

CCc1cc(O)c(F)cc1-c1cc2[nH]ncc2c(NCc2c(F)cccc2N(C)S(C)(=O)=O)n1

BDBM281345

CCN(c1ccccc1CNc1nc(cc2[nH]ncc12)-c1cc(F)c(O)cc1CC)S(=O)(=O)CC

BDBM281346

CCc1cc(O)c(F)cc1-c1nc(NCc2ccccc2N(C)S(C)(=O)=O)c2cn[nH]c2n1

BDBM281347

CCc1cc(O)c(F)cc1-c1nc(N(CCc2ccc(OC)c(OC)c2)Cc2ccccc2N(C)S(C)(=O)=O)c2cn[nH]c2n1

BDBM281348

CCc1cc(O)c(F)cc1-c1cc2[nH]ncc2c(n1)N(CCc1ccc(NS(C)(=O)=O)cc1)Cc1ccccc1N(C)S(C)(=O)=O

BDBM281349

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(C(=O)NC)c2c(NCC(C)C)n1

BDBM281350

CNC(=O)c1n[nH]c2cc(nc(NCc3ccccc3N(C)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281351

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(C(=O)NC)c2c(NCc2ccccc2N(C)S(=O)(=O)CC)n1

BDBM281352

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(C(=O)NC)c2c(NCc2cc(Cl)ccc2N(C)S(C)(=O)=O)n1

BDBM281353

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(C(=O)NC)c2c(NCc2c(F)cccc2N(C)S(C)(=O)=O)n1

BDBM281354

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(C(=O)NC)c2c(NCc2cc(F)ccc2N(C)S(C)(=O)=O)n1

BDBM281355

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(C(=O)NC)c2c(NCc2cc(C)ccc2N(C)S(C)(=O)=O)n1

BDBM281356

CCN(c1ccccc1CNc1nc(cc2[nH]nc(C(=O)NC)c12)-c1cc(F)c(O)cc1CC)S(C)(=O)=O

BDBM281357

CCN(c1ccccc1CNc1nc(cc2[nH]nc(C(=O)NC)c12)-c1cc(F)c(O)cc1CC)S(=O)(=O)CC

BDBM281358

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(C(=O)NC)c2c(NCC2CCCC2)n1

BDBM281359

CNC(=O)c1n[nH]c2cc(nc(NCc3cc(C)ccc3N(C)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281360

CNC(=O)c1n[nH]c2cc(nc(NCc3cc(F)ccc3N(C)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281361

CCN(c1ccccc1CNc1nc(cc2[nH]nc(C(=O)NC)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(=O)(=O)CC

BDBM281362

CNC(=O)c1n[nH]c2cc(nc(NCc3cc(Cl)ccc3N(C)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281363

CCc1cc(O)c(F)cc1-c1nc(NCc2ccccc2N(C)S(C)(=O)=O)c2c(n[nH]c2n1)C(=O)NC

BDBM281364

CNC(=O)c1n[nH]c2cc(nc(NCC(C)C)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281365

CNC(=O)c1n[nH]c2cc(nc(NCc3c(F)cccc3N(C)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281366

CNC(=O)c1n[nH]c2cc(nc(NCC3CCCC3)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281367

CCS(=O)(=O)N(C)c1ccccc1CNc1nc(cc2[nH]nc(C(=O)NC)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281368

CCN(c1ccccc1CNc1nc(cc2[nH]nc(C(=O)NC)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281369

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(C(=O)NC)c2c(NCCc2ccc(O)cc2)n1

BDBM281370

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(C(=O)Nc3ccc(C)nc3)c2c(NCc2ccccc2N(C)S(C)(=O)=O)n1

BDBM281371

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(C(=O)NC)c2c(NCc2cc(O)ccc2N(C)S(C)(=O)=O)n1

BDBM281372

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(C(=O)NC)c2c(NCc2ccccc2N(C)S(=O)(=O)c2ccccc2)n1

BDBM281373

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(C(=O)NC)c2c(NCCc2ccc(NS(=O)(=O)c3ccccc3)cc2)n1

BDBM281374

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(-c3nnc(C)[nH]3)c2c(NCc2ccccc2N(C)S(C)(=O)=O)n1

BDBM281375

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(C(=O)NC)c2c(N[C@H](C)c2ccccc2N(C)S(C)(=O)=O)n1 |r|

BDBM281376

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(C(=O)NC)c2c(N[C@@H](C)c2ccccc2N(C)S(C)(=O)=O)n1 |r|

BDBM281377

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(-n3cccn3)c2c(NCc2ccccc2N(C)S(C)(=O)=O)n1

BDBM281378

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(-c3ncc[nH]3)c2c(NCc2ccccc2N(C)S(C)(=O)=O)n1

BDBM281379

CNC(=O)c1n[nH]c2nc(nc(NCc3ccccc3N(C)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281380

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(-c3nc(C)c(C)[nH]3)c2c(NCc2ccccc2N(C)S(C)(=O)=O)n1

BDBM281381

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(-c3nc(C)c[nH]3)c2c(NCc2ccccc2N(C)S(C)(=O)=O)n1

BDBM281382

CN(c1ccccc1CNc1nc(cc2[nH]nc(-n3cccn3)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281383

CN(c1ccccc1CNc1nc(cc2[nH]nc(C(=O)Nc3ccc(C)nc3)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281384

CN(c1ccccc1CNc1nc(cc2[nH]nc(-c3nnc(C)[nH]3)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281385

CN(c1ccc(O)cc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281386

CN(c1ccccc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281387

CN(c1ccccc1CNc1nc(cc2[nH]nc(-c3nnc([nH]3)-c3ccc(C)nc3)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281388

CN(c1ccc(O)cc1CNc1nc(cc2[nH]nc(C(=O)Nc3ccc(NCCO)nc3)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281390

CN(c1ccc(O)cc1CNc1nc(nc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281391

CN(c1ccc(O)cc1CNc1nc(nc2[nH]nc(C(=O)Nc3ccc(NCCO)nc3)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281392

CNC(=O)c1n[nH]c2nc(nc(NCc3ccccc3N(C)S(N)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281393

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(C(=O)NC)c2c(NCc2ccccc2N(C)S(N)(=O)=O)n1

BDBM281394

CN(c1ccc(O)cc1CNc1nc(nc2[nH]nc(-c3nnc([nH]3)C3CCN(CC3)C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281395

CNC(=O)c1n[nH]c2nc(nc(NCc3ccccc3N(C)S(=O)(=O)NC)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281396

CN(c1ccccc1CNc1nc(nc2[nH]nc(-c3nnc([nH]3)C3CCN(CC3)C(=O)CN3CCCC3)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281397

CN(c1ccc(O)cc1CNc1nc(nc2[nH]nc(-c3nc4CNCCc4[nH]3)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281398

CN(c1ccc(O)cc1CNc1nc(nc2[nH]nc(-c3nc4CN(CCc4[nH]3)C(C)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281399

CN(C)CCNC(=O)N1CCc2[nH]c(nc2C1)-c1n[nH]c2nc(nc(NCc3cc(O)ccc3N(C)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281400

CNC(=O)c1n[nH]c2cc(nc(NCc3ccccc3N(C)S(=O)(=O)N3CCOC3)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281401

CNC(=O)c1n[nH]c2cc(nc(NCc3cc(O)ccc3N(C)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281402

CNC(=O)c1n[nH]c2nc(nc(NCc3nccnc3N(C)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281403

CNC(=O)c1n[nH]c2cc(nc(NCc3nccnc3N(C)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281404

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(C(N)=O)c2c(NCc2ccccc2N(C)S(=O)(=O)c2ccccc2)n1

BDBM281405

CC(CO)CNc1nc(nc2[nH]nc(-c3nc4CN(Cc5ccccc5)CCc4[nH]3)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281406

CN(c1ccccc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(=O)(=O)c1ccccc1

BDBM281407

CSCCNc1nc(cc2[nH]nc(-c3nc4CN(Cc5ccccc5)CCc4[nH]3)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281408

CCc1cc(O)c(F)cc1-c1nc(NCc2ccccc2N(C)S(=O)(=O)c2ccccc2)c2c(n[nH]c2n1)C(N)=O

BDBM281409

CN(c1ccccc1CNc1nc(nc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(=O)(=O)c1ccccc1

BDBM281410

CNC(=O)c1n[nH]c2nc(nc(NCc3ccccc3N(CCO)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281411

Oc1cc(CC(F)(F)F)c(cc1F)-c1nc(NCCC2CC2)c2cn[nH]c2n1

BDBM281412

Oc1cc(CC(F)(F)F)c(cc1F)-c1nc(NCC2CC2)c2cn[nH]c2n1

BDBM281413

CCCCNc1nc(nc2[nH]ncc12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281414

CC(C)CNc1nc(nc2[nH]ncc12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281415

CNC(=O)c1n[nH]c2cc(nc(NCc3ccccc3N(CCO)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281416

CS(=O)(=O)N(CCO)c1ccccc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281417

CS(=O)(=O)N(CCO)c1ccccc1CNc1nc(nc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281418

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(C(=O)NC)c2c(NCc2ccc(O)cc2N(C)S(C)(=O)=O)n1

BDBM281419

CCc1cc(O)c(F)cc1-c1cc2[nH]nc(C(N)=O)c2c(NCc2ccc(O)cc2N(C)S(C)(=O)=O)n1

BDBM281420

CN(c1cc(O)ccc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281421

CNC(=O)c1n[nH]c2cc(nc(NCc3ccc(O)cc3N(C)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281422

CCN(c1ccccc1CNc1nc(nc2[nH]nc(C(=O)NC)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281423

CNC(=O)c1n[nH]c2cc(nc(NCc3ccccc3N(C)S(=O)(=O)c3cccc(O)c3)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281424

CCN(c1ccccc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281425

CCN(c1ccc(O)cc1CNc1nc(cc2[nH]nc(C(=O)NC)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281426

CNC(=O)c1n[nH]c2nc(nc(NCc3cc(O)ccc3N(C)S(=O)(=O)c3ccccc3)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281427

CNC(=O)c1n[nH]c2cc(nc(NCc3cnccc3N(C)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281428

CCN(c1ccc(O)cc1CNc1nc(nc2[nH]nc(C(=O)NC)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(=O)(=O)c1ccccc1

BDBM281429

CNC(=O)c1n[nH]c2cc(nc(NCc3cc(O)ccc3N(C)S(=O)(=O)c3ccccc3)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281430

CN(c1ccc(O)cc1CNc1nc(nc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(=O)(=O)c1ccccc1

BDBM281431

CCN(c1ccc(O)cc1CNc1nc(nc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(=O)(=O)c1ccccc1

BDBM281432

CCN(c1ccc(O)cc1CNc1nc(cc2[nH]nc(C(=O)NC)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(=O)(=O)c1ccccc1

BDBM281433

CNC(=O)c1n[nH]c2cc(nc(NCc3ccccc3N(C)S(=O)(=O)c3cccnc3)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281434

CN(c1ccc(O)cc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(=O)(=O)c1ccccc1

BDBM281435

CCN(c1ccc(O)cc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(=O)(=O)c1ccccc1

BDBM281436

CCN(c1nccnc1CNc1nc(cc2[nH]nc(C(=O)NC)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281437

CNC(=O)c1n[nH]c2cc(nc(NCc3ccccc3N(C)S(=O)(=O)N(C)C)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281438

CCNC(=O)c1n[nH]c2cc(nc(NCc3nccnc3N(CC)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281439

CNC(=O)c1n[nH]c2cc(nc(NCc3nccnc3N(C)S(=O)(=O)c3ccccc3)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281440

CNC(=O)c1n[nH]c2cc(nc(NCc3ccccc3N(C)S(=O)(=O)c3cn[nH]c3)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281441

CNC(=O)c1n[nH]c2cc(nc(NCc3ccccc3N(C)S(=O)(=O)c3cn(C)cn3)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281442

CNC(=O)c1n[nH]c2cc(nc(NCc3cccnc3N(C)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281443

CN(c1ccc(F)cc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281444

CCN(c1ncccc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281445

CN(c1ncccc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281446

CCN(c1ncccc1CNc1nc(cc2[nH]nc(C(=O)NC)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281447

CNC(=O)c1n[nH]c2nc(nc(NCc3cc(F)ccc3N(C)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281448

CNC(=O)c1n[nH]c2cc(nc(NCc3cc(O)ccc3N(C)S(=O)(=O)c3cccnc3)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281449

CNC(=O)c1n[nH]c2cc(nc(NCc3ccccc3CS(N)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281450

CNC(=O)c1n[nH]c2cc(nc(NCc3ncccc3N(C)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281451

CNC(=O)c1n[nH]c2cc(nc(NCc3ccccc3N(C)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1C1CC1

BDBM281452

CNC(=O)c1n[nH]c2cc(nc(NCc3ccccc3N(C)S(=O)(=O)CCOC)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281453

CN(c1ccccc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1C1CC1)S(C)(=O)=O

BDBM281454

CN(c1ccccc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(=O)(=O)c1ccc(nc1)N1CCOCC1

BDBM281455

CNC(=O)c1n[nH]c2cc(nc(NCc3ccccc3N(C)S(=O)(=O)c3ccc(C)nc3)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281456

CN(c1ccccc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(=O)(=O)c1cccnc1

BDBM281457

CN(c1ccccc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(=O)(=O)c1ccc(C)nc1

BDBM281458

CN(c1ccc(Cl)cc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281459

CNC(=O)c1n[nH]c2cc(nc(NCc3cc(C)cnc3N(C)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281460

CN(c1ccccc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(=O)(=O)CCCN1CCOCC1

BDBM281461

CN(c1ncc(C)cc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281462

CNC(=O)c1n[nH]c2cc(nc(NCc3cccnc3N(C)S(C)(=O)=O)c12)-c1cc(F)c(O)cc1C1CC1

BDBM281463

CCN(c1ncc(C)cc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281464

CCN(c1ccc(Cl)cc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281465

CCN(c1ccc(F)cc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281466

CCN(c1ccc(C)cc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281467

CCN(c1ncc(Cl)cc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281468

CN(c1ncc(Cl)cc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281469

CCc1cc(O)cc(C)c1-c1cc2[nH]ncc2c(NCc2ccccc2N(C)S(C)(=O)=O)n1

BDBM281470

CCS(=O)(=O)N(C)c1ccccc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM281471

CN(c1ncc(F)cc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281472

CCN(c1ncc(F)cc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281473

CCN(c1nccnc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM281474

CCN(c1ccccc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(=O)(=O)CC

BDBM281475

CN(c1ccc(C)cc1CNc1nc(cc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM286095

CN([C@H]1CN(CC11CC1)C(=O)CC#N)c1ncnc2[nH]ccc12 |r|

BDBM286096

CN(C1CN(CC11CC1)C(=O)CC#N)c1ncnc2[nH]ccc12

BDBM286097

CN([C@@H]1CN(CC11CC1)C(=O)CC#N)c1ncnc2[nH]ccc12 |r|

BDBM286098

CN([C@H]1CN(CC11CC1)S(=O)(=O)c1cccc(c1)C#N)c1ncnc2[nH]ccc12 |r|

BDBM286099

CCS(=O)(=O)N1CC(N(C)c2ncnc3[nH]ccc23)C2(CC2)C1

BDBM286208

CCc1cc(O)ccc1-c1cc(N)c(C=N)c(NCc2ccccc2N(C)SC)n1

BDBM286210

CCc1cc(O)ccc1-c1cc2[nH]ncc2c(NCc2c(C)cccc2N(C)S(C)(=O)=O)n1

BDBM286213

CCc1cc(O)ccc1-c1cc(N)c(C=N)c(NCCc2ccc(cc2)-c2ccccc2)n1

BDBM286215

CCc1cc(O)ccc1-c1cc2[nH]ncc2c(n1)N1CCc2c(C1)cccc2NS(C)(=O)=O

BDBM286220

CCc1cc(O)c(F)cc1-c1cc(N)c(C=N)c(NCc2cc(C)ccc2N(C)S(C)(=O)=O)n1

BDBM286230

CCc1cc(O)ccc1-c1cc(N)c(C=N)c(n1)N1CC(C1)Oc1ccccc1

BDBM286243

CCc1cc(O)ccc1-c1cc(N)c(C=N)c(n1)N1CC(C)(O)C1

BDBM286314

CCN(c1ccccc1CNc1nc(cc(N)c1C=N)-c1cc(F)c(O)cc1CC)S(C)(=O)=O

BDBM286315

CCCCN(c1ccccc1CNc1nc(cc(N)c1C=N)-c1cc(F)c(O)cc1CC)S(C)(=O)=O

BDBM286322

CCN(c1ccccc1CN(C)c1nc(cc(N)c1C=N)-c1cc(F)c(O)cc1CC)S(C)(=O)=O

BDBM286328

CCc1cc(O)c(F)cc1-c1cc(N)c(C=N)c(NCc2ccccc2N(CCO)S(C)(=O)=O)n1

BDBM286338

CN(c1ccccc1CNc1nc(cc(N)c1C=N)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM286364

CCc1cc(O)c(F)cc1-c1cc(N)c(C=N)c(NCc2c(F)cccc2N(C)S(C)(=O)=O)n1

BDBM286373

CCc1cc(O)c(F)cc1-c1cc(N)c(C=N)c(NCc2ccccc2N(C)S(C)(=O)=O)n1

BDBM286376

CCc1cc(O)c(F)cc1-c1cc(N)c(C=N)c(n1)N(CCc1ccc(OC)c(OC)c1)Cc1ccccc1N(C)S(C)(=O)=O

BDBM286976

CCN(c1ccccc1CNc1nc(cc(N)c1C(=N)C(=O)NC)-c1cc(F)c(O)cc1CC)S(C)(=O)=O

BDBM286979

CNC(=O)C(=N)c1c(N)cc(nc1NCc1cc(C)ccc1N(C)S(C)(=O)=O)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM286985

CNC(=O)C(=N)c1c(N)cc(nc1NCc1c(F)cccc1N(C)S(C)(=O)=O)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM286993

CCc1cc(O)c(F)cc1-c1cc(N)c(C(=N)C(=O)NC)c(NCCc2ccc(NS(=O)(=O)c3ccccc3)cc2)n1

BDBM287004

CN(c1ccccc1CNc1nc(cc2[nH]nc(C(=N)NC(C)=N)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM287009

CN(c1ccccc1CNc1nc(nc2[nH]nc(C(N)=O)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM287010

CN(c1ccc(O)cc1CNc1nc(nc(N)c1C(=N)C(N)=O)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM287014

CN(c1ccc(O)cc1CNc1nc(nc(N)c1C(=N)C(=N)NC(=N)C1CCN(CC1)C(N)=O)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM287016

CN(c1ccccc1CNc1nc(nc2[nH]nc(C(=N)NC(=N)C3CCN(CC3)C(=O)CN3CCCC3)c12)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM287017

CN(c1ccc(O)cc1CNc1nc(nc(N)c1C(=N)c1nc2CNCCc2[nH]1)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM287020

CNC(=O)c1n[nH]c2cc(nc(NCc3ccccc3N(C)S(=O)(=O)NCCO)c12)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM287021

CNC(=O)C(=N)c1c(N)cc(nc1NCc1cc(O)ccc1N(C)S(C)(=O)=O)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM287023

CNC(=O)C(=N)c1c(N)cc(nc1NCc1nccnc1N(C)S(C)(=O)=O)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM287024

CCc1cc(O)c(F)cc1-c1cc(N)c(C(=N)C(N)=O)c(NCc2ccccc2N(C)S(=O)(=O)c2ccccc2)n1

BDBM287028

CCc1cc(O)c(F)cc1-c1nc(N)c(C(=N)C(N)=O)c(NCc2ccccc2N(C)S(=O)(=O)c2ccccc2)n1

BDBM287029

CN(c1ccccc1CNc1nc(nc(N)c1C(=N)C(N)=O)-c1cc(F)c(O)cc1CC(F)(F)F)S(=O)(=O)c1ccccc1

BDBM287031

Nc1nc(nc(NCCC2CC2)c1C=N)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM287033

CCCCNc1nc(nc(N)c1C=N)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM287034

CC(C)CNc1nc(nc(N)c1C=N)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM287036

CS(=O)(=O)N(CCO)c1ccccc1CNc1nc(cc(N)c1C(=N)C(N)=O)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM287054

CN(c1ccc(O)cc1CNc1nc(cc(N)c1C(=N)C(N)=O)-c1cc(F)c(O)cc1CC(F)(F)F)S(=O)(=O)c1ccccc1

BDBM287059

CNC(=O)C(=N)c1c(N)cc(nc1NCc1nccnc1N(C)S(=O)(=O)c1ccccc1)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM287062

CNC(=O)C(=N)c1c(N)cc(nc1NCc1cccnc1N(C)S(C)(=O)=O)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM287068

CNC(=O)C(=N)c1c(N)cc(nc1NCc1cc(O)ccc1N(C)S(=O)(=O)c1cccnc1)-c1cc(F)c(O)cc1CC(F)(F)F

BDBM287071

CNC(=O)C(=N)c1c(N)cc(nc1NCc1ccccc1N(C)S(C)(=O)=O)-c1cc(F)c(O)cc1C1CC1

BDBM287076

CN(c1ccccc1CNc1nc(cc(N)c1C(=N)C(N)=O)-c1cc(F)c(O)cc1CC(F)(F)F)S(=O)(=O)c1cccnc1

BDBM287078

CN(c1ccc(Cl)cc1CNc1nc(cc(N)c1C(=N)C(N)=O)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM287083

CCN(c1ncc(C)cc1CNc1nc(cc(N)c1C(=N)C(N)=O)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM287086

CCN(c1ccc(C)cc1CNc1nc(cc(N)c1C(=N)C(N)=O)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM287094

CCN(c1ccccc1CNc1nc(cc(N)c1C(=N)C(N)=O)-c1cc(F)c(O)cc1CC(F)(F)F)S(=O)(=O)CC

BDBM287095

CN(c1ccc(C)cc1CNc1nc(cc(N)c1C(=N)C(N)=O)-c1cc(F)c(O)cc1CC(F)(F)F)S(C)(=O)=O

BDBM292104

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCc2[nH]1)C1CN(C)C1

BDBM292105

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCc2[nH]1)C1CNC1

BDBM292106

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCc2[nH]1)C1CN(C1)C(C)C

BDBM292107

CCC(C)N1CC(C1)N1CCc2[nH]c(nc2C1)-c1n[nH]c2cc(ccc12)-c1cc(F)c(O)cc1CC

BDBM292108

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCc2[nH]1)C1CN(C1)C1CC1

BDBM292109

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCc2[nH]1)C1CCN(C)CC1

BDBM292110

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCN(C)C)CCc2[nH]1

BDBM292111

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCNC3CC(C3)OC)CCc2[nH]1 |(-11.45,-2.63,;-10.11,-1.86,;-10.11,-.32,;-11.45,.45,;-11.45,1.99,;-12.78,2.76,;-10.11,2.76,;-10.11,4.3,;-8.78,1.99,;-8.78,.45,;-7.44,-.32,;-6.11,.45,;-4.78,-.32,;-4.78,-1.86,;-3.63,-2.89,;-4.26,-4.3,;-5.79,-4.14,;-6.11,-2.63,;-7.44,-1.86,;-2.15,-2.49,;-1.24,-1.25,;.22,-1.72,;1.56,-.95,;2.89,-1.72,;4.23,-.95,;5.56,-1.72,;6.89,-.95,;8.23,-1.72,;8.62,-3.21,;10.11,-2.81,;9.71,-1.32,;11.45,-3.58,;12.78,-2.81,;2.89,-3.26,;1.56,-4.03,;.22,-3.26,;-1.24,-3.74,)|

BDBM292112

CCN(C)CCN1CCc2[nH]c(nc2C1)-c1n[nH]c2cc(ccc12)-c1cc(F)c(O)cc1CC

BDBM292113

CCC(C)N(C)CCN1CCc2[nH]c(nc2C1)-c1n[nH]c2cc(ccc12)-c1cc(F)c(O)cc1CC

BDBM292114

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(C[C@@H]3CCCN3C)CCc2[nH]1 |r|

BDBM292115

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CC(F)CN(C)C)CCc2[nH]1

BDBM292116

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(C[C@H]3COCCN3)CCc2[nH]1 |r|

BDBM292117

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(C[C@@H]3COCCN3)CCc2[nH]1 |r|

BDBM292118

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCN3CCC[C@@H]3C)CCc2[nH]1 |r|

BDBM292119

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCN3CCCC3)CCc2[nH]1

BDBM292120

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCc2[nH]1)C1CN(CCO)C1C

BDBM292121

CCN1CC(C1C)N1CCc2[nH]c(nc2C1)-c1n[nH]c2cc(ccc12)-c1cc(F)c(O)cc1CC

BDBM292122

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCc2[nH]1)C1CN(CCOC)C1

BDBM292123

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCc2[nH]1)C1CN(CCC#N)C1

BDBM292124

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCc2[nH]1)C1CCNCC1

BDBM292125

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCNC3CC(C3)OC)CCc2[nH]1 |(-9.45,-2.63,;-8.11,-1.86,;-8.11,-.32,;-9.45,.45,;-9.45,1.99,;-10.78,2.76,;-8.11,2.76,;-8.11,4.3,;-6.78,1.99,;-6.78,.45,;-5.44,-.32,;-4.11,.45,;-2.78,-.32,;-2.78,-1.86,;-1.63,-2.89,;-2.26,-4.3,;-3.79,-4.14,;-4.11,-2.63,;-5.44,-1.86,;-.15,-2.49,;.76,-1.25,;2.22,-1.72,;3.56,-.95,;4.89,-1.72,;6.23,-.95,;7.56,-1.72,;8.89,-.95,;8.89,.59,;8.12,1.92,;9.03,3.17,;9.8,1.83,;9.11,4.7,;7.82,5.54,;4.89,-3.26,;3.56,-4.03,;2.22,-3.26,;.76,-3.74,)|

BDBM292126

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(C[C@@H]3CCCN3)CCc2[nH]1 |r|

BDBM292127

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(C[C@H]3CCCN3)CCc2[nH]1 |r|

BDBM292129

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCc2[nH]1)C1CCNC1

BDBM292130

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCc2[nH]1)C1CCN(C)C1

BDBM292131

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CC3CNC3)CCc2[nH]1

BDBM305802

OCc1cc(no1)-c1cn2nccc2c(n1)-c1cnn(c1)[C@]1(CC#N)C[C@@H](C1)C#N |r,wD:21.24,26.32,(5.66,-5.95,;4.57,-4.86,;3.08,-5.26,;2.18,-4.01,;.71,-4.49,;.71,-6.03,;2.18,-6.5,;-.62,-3.72,;-1.96,-4.49,;-3.29,-3.72,;-4.75,-4.19,;-5.66,-2.95,;-4.75,-1.7,;-3.29,-2.18,;-1.96,-1.41,;-.62,-2.18,;-1.96,.13,;-3.2,1.04,;-2.73,2.5,;-1.19,2.5,;-.71,1.04,;-.42,3.84,;-1.96,3.84,;-2.73,5.17,;-3.5,6.5,;-.02,5.32,;1.47,4.93,;1.07,3.44,;2.8,5.7,;4.14,6.47,)|

BDBM305803

OCc1cc(n[nH]1)-c1cn2nccc2c(n1)-c1cnn(c1)C1(CC#N)CN(CC2CC2)C1

BDBM305804

CCN1CC(CC#N)(C1)n1cc(cn1)-c1nc(cn2nccc12)-c1cc(CO)[nH]n1

BDBM305805

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)C1(CC#N)CCC1

BDBM305806

CO[C@H]1C[C@@](CC#N)(C1)n1cc(cn1)-c1nc(cn2nccc12)-c1cc(NC(C)=O)[nH]n1 |r,wU:2.1,wD:4.9,(5.78,11.69,;7.21,11.14,;7.46,9.62,;8.7,8.71,;7.8,7.47,;9.04,6.56,;8.88,5.03,;8.72,3.5,;6.55,8.37,;6.89,6.22,;7.37,4.76,;6.12,3.85,;4.87,4.76,;5.35,6.22,;6.12,2.31,;7.45,1.54,;7.45,,;6.12,-.77,;4.79,,;3.32,-.48,;2.42,.77,;3.32,2.02,;4.79,1.54,;8.79,-.77,;10.19,-.14,;11.23,-1.29,;12.76,-1.13,;13.66,-2.37,;15.19,-2.21,;13.04,-3.78,;10.46,-2.62,;8.95,-2.3,)|

BDBM305808

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)C1(CC#N)CN(CC#N)C1

BDBM305809

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM305810

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)C1(CC#N)CN(C1)S(=O)(=O)C1CC1

BDBM305811

CCC(=O)N1CC(CC#N)(C1)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C)c1

BDBM305812

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)[C@]1(CC#N)C[C@H](CC#N)C1 |r,wD:20.23,25.29,(7.49,-1.96,;6.87,-.55,;5.36,-.23,;5.2,1.3,;6.6,1.93,;7.64,.78,;3.86,2.07,;2.53,1.3,;1.2,2.07,;-.27,1.6,;-1.17,2.84,;-.27,4.09,;1.2,3.61,;2.53,4.38,;3.86,3.61,;2.53,5.92,;1.28,6.83,;1.76,8.29,;3.3,8.29,;3.78,6.83,;4.21,9.54,;5.45,8.63,;5.29,7.1,;5.13,5.57,;2.96,10.44,;3.86,11.69,;3.62,13.21,;2.19,13.76,;.75,14.31,;5.11,10.78,)|

BDBM305813

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)[C@@]1(CC#N)C[C@H](CC#N)C1 |r,wU:20.23,wD:25.29,(7.49,-1.96,;6.87,-.55,;5.36,-.23,;5.2,1.3,;6.6,1.93,;7.64,.78,;3.86,2.07,;2.53,1.3,;1.2,2.07,;-.27,1.6,;-1.17,2.84,;-.27,4.09,;1.2,3.61,;2.53,4.38,;3.86,3.61,;2.53,5.92,;1.28,6.83,;1.76,8.29,;3.3,8.29,;3.78,6.83,;4.21,9.54,;5.45,8.63,;5.29,7.1,;5.13,5.57,;2.96,10.44,;3.86,11.69,;3.62,13.21,;2.19,13.76,;.75,14.31,;5.11,10.78,)|

BDBM305814

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)[C@]1(CC#N)C[C@H](O)C1 |r,wD:20.23,25.29,(7.49,-1.96,;6.87,-.55,;5.36,-.23,;5.2,1.3,;6.6,1.93,;7.64,.78,;3.86,2.07,;2.53,1.3,;1.2,2.07,;-.27,1.6,;-1.17,2.84,;-.27,4.09,;1.2,3.61,;2.53,4.38,;3.86,3.61,;2.53,5.92,;1.28,6.83,;1.76,8.29,;3.3,8.29,;3.78,6.83,;4.21,9.54,;5.45,8.63,;6.86,9.26,;8.27,9.89,;2.96,10.44,;3.86,11.69,;3.62,13.21,;5.11,10.78,)|

BDBM305815

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)[C@@]1(CC#N)C[C@H](O)C1 |r,wU:20.23,wD:25.29,(7.49,-1.96,;6.87,-.55,;5.36,-.23,;5.2,1.3,;6.6,1.93,;7.64,.78,;3.86,2.07,;2.53,1.3,;1.2,2.07,;-.27,1.6,;-1.17,2.84,;-.27,4.09,;1.2,3.61,;2.53,4.38,;3.86,3.61,;2.53,5.92,;1.28,6.83,;1.76,8.29,;3.3,8.29,;3.78,6.83,;4.21,9.54,;5.45,8.63,;6.86,9.26,;8.27,9.89,;2.96,10.44,;3.86,11.69,;3.62,13.21,;5.11,10.78,)|

BDBM305816

CO[C@H]1C[C@@](CC#N)(C1)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C)c1 |r,wU:2.1,wD:4.9,(5.78,11.69,;7.21,11.14,;7.46,9.62,;8.7,8.71,;7.8,7.47,;9.04,6.56,;8.88,5.03,;8.72,3.5,;6.55,8.37,;6.89,6.22,;7.37,4.76,;6.12,3.85,;4.87,4.76,;5.35,6.22,;6.12,2.31,;7.45,1.54,;7.45,,;6.12,-.77,;4.79,,;3.32,-.48,;2.42,.77,;3.32,2.02,;4.79,1.54,;8.79,-.77,;10.19,-.14,;11.23,-1.29,;10.46,-2.62,;11.08,-4.03,;8.95,-2.3,)|

BDBM305817

CO[C@H]1C[C@](CC#N)(C1)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C)c1 |r,wU:2.1,4.9,(5.78,11.69,;7.21,11.14,;7.46,9.62,;8.7,8.71,;7.8,7.47,;9.04,6.56,;8.88,5.03,;8.72,3.5,;6.55,8.37,;6.89,6.22,;7.37,4.76,;6.12,3.85,;4.87,4.76,;5.35,6.22,;6.12,2.31,;7.45,1.54,;7.45,,;6.12,-.77,;4.79,,;3.32,-.48,;2.42,.77,;3.32,2.02,;4.79,1.54,;8.79,-.77,;10.19,-.14,;11.23,-1.29,;10.46,-2.62,;11.08,-4.03,;8.95,-2.3,)|

BDBM305818

C[C@H]1N(CC(F)(F)F)C[C@]1(CC#N)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C)c1

BDBM305819

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)[C@@]1(CC#N)C[C@@H](C1)c1ccn[nH]1 |r,wU:20.23,wD:25.31,(7.49,-1.96,;6.87,-.55,;5.36,-.23,;5.2,1.3,;6.6,1.93,;7.64,.78,;3.86,2.07,;2.53,1.3,;1.2,2.07,;-.27,1.6,;-1.17,2.84,;-.27,4.09,;1.2,3.61,;2.53,4.38,;3.86,3.61,;2.53,5.92,;1.28,6.83,;1.76,8.29,;3.3,8.29,;3.78,6.83,;4.21,9.54,;5.45,8.63,;5.29,7.1,;5.13,5.57,;2.96,10.44,;3.86,11.69,;5.11,10.78,;3.62,13.21,;2.25,13.91,;2.49,15.43,;4.01,15.67,;4.71,14.3,)|

BDBM305820

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)[C@]1(CC#N)C[C@@H](C1)C#N |r,wD:20.23,25.31,(7.49,-1.96,;6.87,-.55,;5.36,-.23,;5.2,1.3,;6.6,1.93,;7.64,.78,;3.86,2.07,;2.53,1.3,;1.2,2.07,;-.27,1.6,;-1.17,2.84,;-.27,4.09,;1.2,3.61,;2.53,4.38,;3.86,3.61,;2.53,5.92,;1.28,6.83,;1.76,8.29,;3.3,8.29,;3.78,6.83,;4.21,9.54,;5.45,8.63,;5.29,7.1,;5.13,5.57,;2.96,10.44,;3.86,11.69,;5.11,10.78,;3.62,13.21,;3.38,14.73,)|

BDBM305821

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)[C@@]1(CC#N)C[C@@H](C1)C#N |r,wU:20.23,wD:25.31,(5.9,-6.34,;4.36,-6.34,;3.46,-5.09,;2,-5.57,;2,-7.11,;3.46,-7.59,;.66,-4.8,;-.67,-5.57,;-2.01,-4.8,;-3.47,-5.28,;-4.38,-4.03,;-3.47,-2.78,;-2.01,-3.26,;-.67,-2.49,;.66,-3.26,;-.67,-.95,;.57,-.05,;.1,1.42,;-1.44,1.42,;-1.92,-.05,;-2.53,2.51,;-2.93,1.02,;-4.42,.62,;-5.9,.22,;-3.86,3.28,;-3.09,4.61,;-1.76,3.84,;-3.49,6.1,;-3.89,7.59,)|

BDBM305822

Cc1nn(cc1-c1nc(cn2nccc12)-c1cnn(C)c1)[C@@]1(CC#N)C[C@@H](C1)C#N |r,wU:21.24,wD:26.32,(3.41,4.28,;4.87,4.76,;5.35,6.22,;6.89,6.22,;7.37,4.76,;6.12,3.85,;6.12,2.31,;7.45,1.54,;7.45,,;6.12,-.77,;4.79,,;3.32,-.48,;2.42,.77,;3.32,2.02,;4.79,1.54,;8.79,-.77,;10.19,-.14,;11.23,-1.29,;10.46,-2.62,;11.08,-4.03,;8.95,-2.3,;7.8,7.47,;9.04,6.56,;8.88,5.03,;8.72,3.5,;6.55,8.37,;7.46,9.62,;8.7,8.71,;7.21,11.14,;6.97,12.66,)|

BDBM305823

Cn1cc(c(CO)n1)-c1cn2nccc2c(n1)-c1cnn(c1)[C@@]1(CC#N)C[C@@H](C1)C#N |r,wU:22.25,wD:27.33,(7.49,-1.96,;6.87,-.55,;5.36,-.23,;5.2,1.3,;6.6,1.93,;6.92,3.44,;8.39,3.91,;7.64,.78,;3.86,2.07,;2.53,1.3,;1.2,2.07,;-.27,1.6,;-1.17,2.84,;-.27,4.09,;1.2,3.61,;2.53,4.38,;3.86,3.61,;2.53,5.92,;1.28,6.83,;1.76,8.29,;3.3,8.29,;3.78,6.83,;4.21,9.54,;5.45,8.63,;5.29,7.1,;5.13,5.57,;2.96,10.44,;3.86,11.69,;5.11,10.78,;3.62,13.21,;3.38,14.73,)|

BDBM305824

Cn1cc(c(N)n1)-c1cn2nccc2c(n1)-c1cnn(c1)[C@@]1(CC#N)C[C@@H](C1)C#N |r,wU:21.24,wD:26.32,(7.49,-1.96,;6.87,-.55,;5.36,-.23,;5.2,1.3,;6.6,1.93,;6.92,3.44,;7.64,.78,;3.86,2.07,;2.53,1.3,;1.2,2.07,;-.27,1.6,;-1.17,2.84,;-.27,4.09,;1.2,3.61,;2.53,4.38,;3.86,3.61,;2.53,5.92,;1.28,6.83,;1.76,8.29,;3.3,8.29,;3.78,6.83,;4.21,9.54,;5.45,8.63,;5.29,7.1,;5.13,5.57,;2.96,10.44,;3.86,11.69,;5.11,10.78,;3.62,13.21,;3.38,14.73,)|

BDBM305825

CO[C@H]1C[C@@](CC#N)(C1)n1cc(cn1)-c1nc(cn2nccc12)-c1cc(N)n(C)n1 |r,wU:2.1,wD:4.9,(5.78,11.69,;7.21,11.14,;7.46,9.62,;8.7,8.71,;7.8,7.47,;9.04,6.56,;8.88,5.03,;8.72,3.5,;6.55,8.37,;6.89,6.22,;7.37,4.76,;6.12,3.85,;4.87,4.76,;5.35,6.22,;6.12,2.31,;7.45,1.54,;7.45,,;6.12,-.77,;4.79,,;3.32,-.48,;2.42,.77,;3.32,2.02,;4.79,1.54,;8.79,-.77,;10.19,-.14,;11.23,-1.29,;12.76,-1.13,;10.46,-2.62,;11.08,-4.03,;8.95,-2.3,)|

BDBM305826

Cc1cnn2cc(nc(-c3cnn(c3)[C@@]3(CC#N)C[C@@H](C3)C#N)c12)-c1cnn(C)c1 |r,wU:14.14,wD:19.22,(-3.81,-.37,;-3.04,-1.7,;-3.95,-2.95,;-3.04,-4.19,;-1.58,-3.72,;-.24,-4.49,;1.09,-3.72,;1.09,-2.18,;-.24,-1.41,;-.24,.13,;1,1.04,;.53,2.5,;-1.01,2.5,;-1.49,1.04,;-1.78,3.84,;-.24,3.84,;.53,5.17,;1.3,6.5,;-3.27,3.44,;-3.67,4.93,;-2.18,5.32,;-5,5.7,;-6.34,6.47,;-1.58,-2.18,;2.43,-4.49,;2.43,-6.03,;3.89,-6.5,;4.8,-5.26,;6.34,-5.26,;3.89,-4.01,)|

BDBM305827

Cc1cc(n[nH]1)-c1cn2nccc2c(n1)-c1cnn(c1)[C@@]1(CC#N)C[C@@H](C1)C#N |r,wU:20.23,wD:25.31,(5.18,-4.05,;3.85,-4.82,;2.6,-3.92,;1.35,-4.82,;1.83,-6.29,;3.37,-6.29,;-.15,-4.5,;-1.18,-5.65,;-2.69,-5.33,;-3.93,-6.23,;-5.18,-5.33,;-4.7,-3.86,;-3.16,-3.86,;-2.13,-2.72,;-.63,-3.04,;-2.61,-1.25,;-4.07,-.78,;-4.07,.76,;-2.61,1.24,;-1.7,-.01,;-1.84,2.57,;-3.38,2.57,;-4.15,3.9,;-4.92,5.24,;-1.84,4.11,;-.3,4.11,;-.3,2.57,;.79,5.2,;1.88,6.29,)|

BDBM305828

CO[C@H]1C[C@](CC#N)(C1)n1cc(cn1)-c1nc(cn2nccc12)-c1cc(CO)[nH]n1 |r,wD:4.9,2.1,(.31,7.04,;.71,5.55,;-.38,4.46,;-1.92,4.46,;-1.92,2.92,;-3.63,3.15,;-4.4,4.49,;-5.17,5.82,;-.38,2.92,;-2.86,1.82,;-1.95,.57,;-2.86,-.67,;-4.32,-.2,;-4.32,1.34,;-2.38,-2.14,;-.88,-2.46,;-.4,-3.92,;-1.43,-5.07,;-2.94,-4.75,;-4.18,-5.65,;-5.43,-4.75,;-4.95,-3.28,;-3.41,-3.28,;1.1,-4.24,;1.58,-5.71,;3.12,-5.71,;3.89,-7.04,;5.43,-7.04,;3.6,-4.24,;2.35,-3.34,)|

BDBM305829

CO[C@H]1C[C@@](CC#N)(C1)n1cc(cn1)-c1nc(cn2nccc12)-c1cc(CO)[nH]n1 |r,wU:2.1,wD:4.9,(5.78,11.69,;7.21,11.14,;7.46,9.62,;8.7,8.71,;7.8,7.47,;9.04,6.56,;8.88,5.03,;8.72,3.5,;6.55,8.37,;6.89,6.22,;7.37,4.76,;6.12,3.85,;4.87,4.76,;5.35,6.22,;6.12,2.31,;7.45,1.54,;7.45,,;6.12,-.77,;4.79,,;3.32,-.48,;2.42,.77,;3.32,2.02,;4.79,1.54,;8.79,-.77,;10.19,-.14,;11.23,-1.29,;12.76,-1.13,;13.38,.28,;10.46,-2.62,;8.95,-2.3,)|

BDBM305830

NC(=O)c1cc(on1)-c1cn2nccc2c(n1)-c1cnn(c1)[C@@]1(CC#N)C[C@@H](C1)C#N |r,wU:22.25,wD:27.33,(9.02,-2.12,;7.49,-1.96,;6.59,-3.2,;6.87,-.55,;5.36,-.23,;5.2,1.3,;6.6,1.93,;7.64,.78,;3.86,2.07,;2.53,1.3,;1.2,2.07,;-.27,1.6,;-1.17,2.84,;-.27,4.09,;1.2,3.61,;2.53,4.38,;3.86,3.61,;2.53,5.92,;1.28,6.83,;1.76,8.29,;3.3,8.29,;3.78,6.83,;4.21,9.54,;5.45,8.63,;5.29,7.1,;5.13,5.57,;2.96,10.44,;3.86,11.69,;5.11,10.78,;3.62,13.21,;3.38,14.73,)|

BDBM305831

CO[C@H]1C[C@@](CC#N)(C1)n1cc(cn1)-c1nc(cn2nccc12)-c1cc(N)[nH]n1 |r,wU:4.9,wD:2.1,(-.8,7.41,;-2.13,6.64,;-2.13,5.1,;-3.22,4.01,;-2.13,2.93,;-2.9,1.59,;-4.44,1.59,;-5.98,1.59,;-1.04,4.01,;-1.36,1.59,;-1.84,.13,;-.59,-.78,;.65,.13,;.18,1.59,;-.59,-2.32,;.74,-3.09,;.74,-4.63,;-.59,-5.4,;-1.93,-4.63,;-3.39,-5.1,;-4.3,-3.86,;-3.39,-2.61,;-1.93,-3.09,;2.07,-5.4,;3.54,-4.92,;4.44,-6.17,;5.98,-6.17,;3.54,-7.41,;2.07,-6.94,)|

BDBM305833

CO[C@H]1C[C@](CC#N)(C1)n1cc(cn1)-c1nc(cn2nccc12)-c1cc(n[nH]1)C(N)=O |r,wU:4.9,2.1,(-6.88,4.85,;-5.55,5.62,;-4.21,4.85,;-2.72,5.25,;-2.33,3.76,;-.79,3.76,;-.02,5.09,;.75,6.42,;-3.81,3.36,;-1.24,2.67,;-1.71,1.2,;-.47,.3,;.78,1.2,;.3,2.67,;-.47,-1.24,;.87,-2.01,;.87,-3.55,;-.47,-4.32,;-1.8,-3.55,;-3.27,-4.03,;-4.17,-2.78,;-3.27,-1.54,;-1.8,-2.01,;2.2,-4.32,;3.66,-3.85,;4.57,-5.09,;3.66,-6.34,;2.2,-5.86,;6.11,-5.09,;6.88,-6.42,;6.88,-3.76,)|

BDBM305834

Cn1cc(nn1)-c1cn2nccc2c(n1)-c1cnn(c1)[C@@]1(CC#N)C[C@@H](C1)C#N |r,wU:20.23,wD:25.31,(3.55,-7.25,;2.78,-5.91,;1.31,-5.44,;1.31,-3.9,;2.78,-3.42,;3.68,-4.67,;-.02,-3.13,;-1.35,-3.9,;-2.69,-3.13,;-4.15,-3.6,;-5.06,-2.36,;-4.15,-1.11,;-2.69,-1.59,;-1.35,-.82,;-.02,-1.59,;-1.35,.72,;-2.6,1.63,;-2.12,3.09,;-.58,3.09,;-.11,1.63,;.5,4.18,;-.98,4.58,;-1.75,5.91,;-2.52,7.25,;.9,5.67,;2.39,5.27,;1.99,3.78,;3.72,6.04,;5.06,6.81,)|

BDBM305835

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)[C@@]1(CC#N)C[C@](C)(C1)C#N |r,wU:20.23,25.32,wD:25.29,(6.7,-5.14,;5.16,-5.14,;4.26,-3.89,;2.79,-4.37,;2.79,-5.91,;4.26,-6.38,;1.46,-3.6,;.12,-4.37,;-1.21,-3.6,;-2.67,-4.07,;-3.58,-2.83,;-2.67,-1.58,;-1.21,-2.06,;.12,-1.29,;1.46,-2.06,;.12,.25,;1.37,1.16,;.89,2.62,;-.65,2.62,;-1.12,1.16,;-1.74,3.71,;-.2,3.71,;.57,5.05,;1.34,6.38,;-3.22,3.32,;-3.62,4.8,;-4.39,6.14,;-2.13,5.2,;-5.16,4.8,;-6.7,4.8,)|

BDBM305836

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)[C@]1(CC#N)C[C@](C)(C1)C#N |r,wU:20.23,25.29,wD:25.32,(6.7,-5.14,;5.16,-5.14,;4.26,-3.89,;2.79,-4.37,;2.79,-5.91,;4.26,-6.38,;1.46,-3.6,;.12,-4.37,;-1.21,-3.6,;-2.67,-4.07,;-3.58,-2.83,;-2.67,-1.58,;-1.21,-2.06,;.12,-1.29,;1.46,-2.06,;.12,.25,;1.37,1.16,;.89,2.62,;-.65,2.62,;-1.12,1.16,;-1.74,3.71,;-.2,3.71,;.57,5.05,;1.34,6.38,;-2.13,5.2,;-3.62,4.8,;-4.71,5.89,;-3.22,3.32,;-5.16,4.8,;-6.7,4.8,)|

BDBM305837

Cc1cc2c(nc(cn2n1)-c1cnn(C)c1)-c1cnn(c1)[C@@]1(CC#N)C[C@@H](C1)C#N |r,wU:21.24,wD:26.32,(-5.91,-2.95,;-4.37,-2.95,;-3.47,-1.7,;-2,-2.18,;-.67,-1.41,;.67,-2.18,;.67,-3.72,;-.67,-4.49,;-2,-3.72,;-3.47,-4.19,;2,-4.49,;2,-6.03,;3.47,-6.5,;4.37,-5.26,;5.91,-5.26,;3.47,-4.01,;-.67,.13,;-1.91,1.04,;-1.44,2.5,;.1,2.5,;.58,1.04,;.87,3.84,;-.67,3.84,;-1.44,5.17,;-2.21,6.5,;1.27,5.32,;2.76,4.93,;2.36,3.44,;4.09,5.7,;5.43,6.47,)|

BDBM305838

Cn1cc(-c2cn3nccc3c(n2)-c2cnn(c2)[C@@]2(CC#N)C[C@@H](C2)C#N)c(=O)[nH]1 |r,wU:18.20,wD:23.28,(4.47,-8.11,;3.7,-6.78,;2.23,-6.3,;2.23,-4.76,;.9,-3.99,;-.43,-4.76,;-1.77,-3.99,;-3.23,-4.47,;-4.14,-3.22,;-3.23,-1.98,;-1.77,-2.45,;-.43,-1.68,;.9,-2.45,;-.43,-.14,;.81,.76,;.34,2.23,;-1.2,2.23,;-1.68,.76,;-1.97,3.56,;-.43,3.56,;.34,4.89,;1.11,6.23,;-3.46,3.96,;-3.06,5.45,;-1.58,5.05,;-3.83,6.78,;-4.6,8.11,;3.7,-4.29,;4.47,-2.95,;4.6,-5.53,)|

BDBM322632

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)C1=NC2CN(CCC2N1)C1CN(C1)C(C)C |t:22|

BDBM325339

CCOC(C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C)c1

BDBM325340

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)C1CCCCCC1

BDBM325341

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCN2CCOCC2)c1

BDBM325342

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC2CCOCC2)c1

BDBM325343

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC(=O)N(C)C)c1

BDBM325344

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC(=O)N2CCOCC2)c1

BDBM325345

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCCS(C)(=O)=O)c1

BDBM325346

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC2CNC(=O)O2)c1

BDBM325347

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCN(C)S(C)(=O)=O)c1

BDBM325348

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCN(C)C)c1

BDBM325349

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC2CCS(=O)(=O)CC2)c1

BDBM325350

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCCN(C)C)c1

BDBM325351

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CS(=O)(=O)C1

BDBM325352

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](C)CO)c1 |r|

BDBM325353

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](C)CO)c1 |r|

BDBM325354

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC2(CO)COC2)c1

BDBM325355

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H]2CCC(=O)N2)c1 |r|

BDBM325356

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H]2CCC(=O)N2)c1 |r|

BDBM325357

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCCO)c1

BDBM325358

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCO)c1

BDBM325359

CC[C@@H](C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CCS(=O)(=O)CC1 |r|

BDBM325360

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCS(C)(=O)=O)c1

BDBM325361

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCS(=O)(=O)N(C)C)c1

BDBM325362

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCS(N)(=O)=O)c1

BDBM325363

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CCNCC1

BDBM325364

CC(C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CCNCC1

BDBM325365

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H]2CCCN2)c1 |r|

BDBM325366

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H]2CCCN2)c1 |r|

BDBM325367

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@@H]1CCCNC1 |r|

BDBM325368

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H]2COCCN2)c1 |r|

BDBM325369

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CCN(CC1)C(C)=O

BDBM325370

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CCN(CC1)S(C)(=O)=O

BDBM325371

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CCN(CC1)C(=O)COC

BDBM325372

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CCN(CC1)C(=O)NC

BDBM325373

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CCN(CC1)C(=O)N(C)C

BDBM325374

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CCN(CC1)C(=O)CN

BDBM325375

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CN(C1)S(C)(=O)=O

BDBM325376

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CN(C1)C(C)=O

BDBM325377

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CN(C1)C(=O)NC

BDBM325378

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CN(C1)C(=O)N(C)C

BDBM325379

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CN(C1)P(=O)(N(C)C)N(C)C

BDBM325380

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CN(C1)C(=O)C(C)C

BDBM325381

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CN(C1)C(=O)C1CC1

BDBM325382

CCC(C(O)=O)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C)c1

BDBM325383

CCC(CO)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C)c1

BDBM325384

CC(CO)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C)c1

BDBM325385

CCC(CCO)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C)c1

BDBM325386

CCC1(CN(C1)S(=O)(=O)C(F)(F)F)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C)c1

BDBM325387

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)C1(C)CCCC1

BDBM325388

CCC(C)(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C)c1

BDBM325389

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)C1CCCC1CO

BDBM325390

CC1CCCCCC1n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C)c1

BDBM325391

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)C1CCCC1O

BDBM325392

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325393

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](O)CO)c1 |r|

BDBM325394

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](O)C(C)(C)O)c1 |r|

BDBM325395

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)C(C)(C)O)c1 |r|

BDBM325396

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC(O)CO)c1

BDBM325397

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)[C@@H](C)O)c1 |r|

BDBM325398

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC(C)(O)CO)c1

BDBM325399

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC(CO)CO)c1

BDBM325400

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCC(O)CO)c1

BDBM325401

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC(O)CCO)c1

BDBM325402

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC[C@@H](O)CO)c1 |r|

BDBM325403

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](O)[C@H](C)O)c1 |r|

BDBM325404

CCC(c1ccccc1)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325405

CCC(C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325406

CC[C@H](C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325407

CC[C@@H](C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325408

CC[C@H](C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](O)CO)c1 |r|

BDBM325409

CC[C@@H](C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](O)CO)c1 |r|

BDBM325410

CCC[C@H](C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325411

CCC[C@@H](C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325412

CCC[C@@H](C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](O)CO)c1 |r|

BDBM325413

CC(C)C[C@H](C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325414

CC(C)C[C@H](C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](O)CO)c1 |r|

BDBM325415

CC(C)C[C@@H](C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325416

CC(C)C[C@@H](C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](O)CO)c1 |r|

BDBM325417

CCC(C1CC(F)(F)C1)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325418

CC(C)[C@H](C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325419

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C(CO)CO

BDBM325420

CCC[C@H](C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C(CO)CO |r|

BDBM325421

CCC[C@@H](C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C(CO)CO |r|

BDBM325422

CC[C@H](C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C(CO)CO |r|

BDBM325423

CC[C@@H](C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C(CO)CO |r|

BDBM325424

CCC[C@H](C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](O)CO)c1 |r|

BDBM325425

CC(C)C[C@H](C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C(CO)CO |r|

BDBM325426

CC(C)C[C@@H](C)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C(CO)CO |r|

BDBM325427

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@@H](C)[C@H](O)CO |r|

BDBM325428

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@H](C)[C@H](O)CO |r|

BDBM325429

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@@H](C)[C@@H](O)CO |r|

BDBM325430

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@H](C)[C@@H](O)CO |r|

BDBM325431

C[C@@H]1CCC[C@@H]1n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325433

CC1(C)CCC[C@@H]1n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325435

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC(=O)NC(C)C)c1

BDBM325436

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC(O)CN)c1

BDBM325437

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](O)CN(C)C)c1 |r|

BDBM325438

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](O)CNC)c1 |r|

BDBM325439

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CN(C)C)c1 |r|

BDBM325440

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CNC)c1 |r|

BDBM325441

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](O)CN2CC(C2)OC)c1 |r|

BDBM325442

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CN2CC(C2)OC)c1 |r|

BDBM325443

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](O)CN2CCCC2)c1 |r|

BDBM325444

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CN2CCCC2)c1 |r|

BDBM325445

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)COC)c1 |r|

BDBM325446

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](O)COC)c1 |r|

BDBM325447

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](C)O)c1 |r|

BDBM325448

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](C)O)c1 |r|

BDBM325449

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC(O)CC(F)(F)F)c1

BDBM325450

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC(O)C(C)(C)C)c1

BDBM325451

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC(O)C(C)C)c1

BDBM325452

CC[C@H](O)Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)C(CC)CC |r|

BDBM325453

CC[C@@H](O)Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)C(CC)CC |r|

BDBM325454

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC2(O)CCOCC2)c1

BDBM325455

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC(C)(C)O)c1

BDBM325456

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CC[C@H](O)CC1 |r,wD:27.31,(.79,4.45,;-.3,3.36,;-1.78,3.76,;-2.18,5.25,;-1.09,6.34,;-2.87,2.67,;-2.4,1.21,;-3.64,.3,;-4.89,1.21,;-4.41,2.67,;-3.64,-1.24,;-2.31,-2.01,;-2.31,-3.55,;-3.64,-4.32,;-4.98,-3.55,;-6.44,-4.03,;-7.35,-2.78,;-6.44,-1.53,;-4.98,-2.01,;-.97,-4.32,;-.97,-5.86,;.49,-6.34,;1.4,-5.09,;.49,-3.84,;2.88,-4.69,;3.28,-3.2,;4.77,-2.81,;5.86,-3.89,;7.35,-3.5,;5.46,-5.38,;3.97,-5.78,)|

BDBM325457

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1C[C@H](O)C1 |r,wU:26.30,(1.23,4.45,;.14,3.36,;-1.35,3.76,;-1.75,5.25,;-.66,6.34,;-2.44,2.67,;-1.96,1.21,;-3.21,.3,;-4.45,1.21,;-3.98,2.67,;-3.21,-1.24,;-1.87,-2.01,;-1.87,-3.55,;-3.21,-4.32,;-4.54,-3.55,;-6,-4.03,;-6.91,-2.78,;-6,-1.53,;-4.54,-2.01,;-.54,-4.32,;-.54,-5.86,;.93,-6.34,;1.83,-5.09,;.93,-3.84,;3.32,-4.69,;4.65,-5.46,;5.42,-4.13,;6.91,-3.73,;4.09,-3.36,)|

BDBM325458

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H]2C[C@H](O)C2)c1 |r,wU:24.26,26.29,(1.71,5.9,;.62,4.82,;-.87,5.21,;-1.26,6.7,;-.18,7.79,;-1.96,4.12,;-1.48,2.66,;-2.73,1.75,;-3.97,2.66,;-3.5,4.12,;-2.73,.21,;-1.39,-.56,;-1.39,-2.1,;-2.73,-2.87,;-4.06,-2.1,;-5.52,-2.57,;-6.43,-1.33,;-5.52,-.08,;-4.06,-.56,;-.06,-2.87,;-.06,-4.41,;1.41,-4.88,;2.31,-3.64,;3.8,-3.24,;4.57,-4.57,;4.17,-6.06,;5.66,-6.46,;6.43,-7.79,;6.06,-4.97,;1.41,-2.39,)|

BDBM325459

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CC[C@H](O)CC1 |r,wU:27.31,(.79,4.45,;-.3,3.36,;-1.78,3.76,;-2.18,5.25,;-1.09,6.34,;-2.87,2.67,;-2.4,1.21,;-3.64,.3,;-4.89,1.21,;-4.41,2.67,;-3.64,-1.24,;-2.31,-2.01,;-2.31,-3.55,;-3.64,-4.32,;-4.98,-3.55,;-6.44,-4.03,;-7.35,-2.78,;-6.44,-1.53,;-4.98,-2.01,;-.97,-4.32,;-.97,-5.86,;.49,-6.34,;1.4,-5.09,;.49,-3.84,;2.88,-4.69,;3.97,-5.78,;5.46,-5.38,;5.86,-3.89,;7.35,-3.5,;4.77,-2.81,;3.28,-3.2,)|

BDBM325460

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC2C[C@H](CO)C2)c1 |r,wU:26.29,(-7.3,12.81,;-6.53,14.15,;-4.99,14.15,;-4.22,15.48,;-2.68,15.48,;-4.22,12.81,;-4.69,11.35,;-3.45,10.44,;-2.2,11.35,;-2.68,12.81,;-3.45,8.9,;-2.11,8.13,;-2.11,6.59,;-3.45,5.82,;-4.78,6.59,;-6.25,6.12,;-7.15,7.36,;-6.25,8.61,;-4.78,8.13,;-.78,5.82,;-.78,4.28,;.68,3.81,;1.59,5.05,;3.13,5.05,;3.9,3.72,;3.5,2.23,;4.99,1.83,;5.76,.5,;7.3,.5,;5.39,3.32,;.68,6.3,)|

BDBM325462

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C(C)(C)CO

BDBM325463

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C(C)CO

BDBM325464

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@@H](C)CO |r|

BDBM325465

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC2CNCCO2)c1

BDBM325466

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H]2CNCCO2)c1 |r|

BDBM325467

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](CO)N(C)C)c1 |r|

BDBM325468

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](N)CO)c1 |r|

BDBM325469

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](CO)N(C)C)c1 |r|

BDBM325470

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@@H]1C[C@H](O)[C@H](O)C1 |r|

BDBM325472

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCNC2CC2)c1

BDBM325473

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCN2CCCC2)c1

BDBM325474

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCN2CC[C@H](C2)OC)c1 |r|

BDBM325475

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCN2CC[C@@H](C2)OC)c1 |r|

BDBM325476

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCN2CC(F)C2)c1

BDBM325477

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCN2CCC(O)CC2)c1

BDBM325478

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCN2CC[C@@H](O)C2)c1 |r|

BDBM325479

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCN2CC[C@H](O)C2)c1 |r|

BDBM325480

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCN[C@H]2CCN(C)C2=O)c1 |r|

BDBM325481

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCN[C@@H]2CCN(C)C2=O)c1 |r|

BDBM325482

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCN2CCNC(=O)C2)c1

BDBM325483

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCNC2CC(CO)C2)c1 |(-.01,7,;-1.09,5.91,;-2.58,6.31,;-2.98,7.8,;-1.89,8.89,;-3.67,5.22,;-3.19,3.76,;-4.44,2.85,;-5.69,3.76,;-5.21,5.22,;-4.44,1.31,;-3.11,.54,;-3.11,-1,;-4.44,-1.77,;-5.77,-1,;-7.24,-1.47,;-8.14,-.23,;-7.24,1.02,;-5.77,.54,;-1.77,-1.77,;-.31,-1.29,;.6,-2.54,;-.31,-3.78,;.09,-5.27,;1.58,-5.67,;1.98,-7.16,;3.46,-7.55,;4.23,-8.89,;5.57,-8.12,;7.06,-8.52,;8.14,-7.43,;4.8,-6.78,;-1.77,-3.31,)|

BDBM325484

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCN2CCC(CO)CC2)c1

BDBM325485

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CCN2CCNCC2=O)c1

BDBM325486

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](CN)OC)c1 |r|

BDBM325487

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](CN)OC)c1 |r|

BDBM325488

C[C@@H]1CCCC[C@H]1n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C(CO)CO |r|

BDBM325489

C[C@@H]1CCCC[C@H]1n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325490

C[C@@H]1CCCC[C@H]1n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](O)CO)c1 |r|

BDBM325491

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@@H]1CCC[C@H]1O |r|

BDBM325492

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@H]1CCC[C@@H]1O |r|

BDBM325493

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@@H](C)[C@H](C)O |r|

BDBM325494

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@H](C)[C@@H](C)O |r|

BDBM325495

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@@H](C)[C@@H](C)O |r|

BDBM325496

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@H](C)[C@H](C)O |r|

BDBM325497

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@@H]1COC[C@H]1O |r|

BDBM325498

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@H]1COC[C@@H]1O |r|

BDBM325499

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@H]1C[C@H](O)C1 |r,wU:26.30,wD:24.27,(-1.67,6.5,;-2.44,5.17,;-1.67,3.84,;-.13,3.84,;.64,5.17,;-2.44,2.5,;-1.96,1.04,;-3.21,.13,;-4.45,1.04,;-3.98,2.5,;-3.21,-1.41,;-1.87,-2.18,;-1.87,-3.72,;-3.21,-4.49,;-4.54,-3.72,;-6,-4.19,;-6.91,-2.95,;-6,-1.7,;-4.54,-2.18,;-.54,-4.49,;-.54,-6.03,;.93,-6.5,;1.83,-5.26,;.93,-4.01,;3.32,-4.86,;4.65,-5.63,;5.42,-4.3,;6.91,-3.9,;4.09,-3.53,)|

BDBM325500

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1C[C@@](C)(O)C1 |r,wU:26.31,wD:26.30,(.46,9.04,;-.31,7.71,;.46,6.38,;2,6.38,;2.77,7.71,;-.31,5.04,;.17,3.58,;-1.08,2.67,;-2.33,3.58,;-1.85,5.04,;-1.08,1.13,;.25,.36,;.25,-1.18,;-1.08,-1.95,;-2.41,-1.18,;-3.88,-1.65,;-4.78,-.41,;-3.88,.84,;-2.41,.36,;1.59,-1.95,;3.05,-1.47,;3.96,-2.72,;3.05,-3.96,;1.59,-3.49,;3.45,-5.45,;4.78,-6.22,;4.01,-7.56,;3.24,-8.89,;4.41,-9.04,;2.68,-6.79,)|

BDBM325501

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1C[C@@](O)(CO)C1 |r,wU:26.30,wD:26.31,(-.1,19.14,;-.87,17.8,;-.1,16.47,;1.44,16.47,;2.21,17.8,;-.87,15.13,;-.39,13.67,;-1.64,12.77,;-2.88,13.67,;-2.41,15.13,;-1.64,11.23,;-.3,10.46,;-.3,8.92,;-1.64,8.15,;-2.97,8.92,;-4.44,8.44,;-5.34,9.69,;-4.44,10.93,;-2.97,10.46,;1.03,8.15,;2.49,8.62,;3.4,7.38,;2.49,6.13,;1.03,6.61,;2.89,4.64,;2.12,3.31,;3.46,2.54,;5,2.54,;3.85,1.05,;5.34,.65,;4.23,3.87,)|

BDBM325503

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1C[C@H](CO)C1 |r,wU:26.30,(-2.21,6.5,;-2.98,5.17,;-2.21,3.84,;-.67,3.84,;.1,5.17,;-2.98,2.5,;-2.5,1.04,;-3.75,.13,;-5,1.04,;-4.52,2.5,;-3.75,-1.41,;-2.42,-2.18,;-2.42,-3.72,;-3.75,-4.49,;-5.08,-3.72,;-6.55,-4.19,;-7.45,-2.95,;-6.55,-1.7,;-5.08,-2.18,;-1.08,-4.49,;-1.08,-6.03,;.38,-6.5,;1.29,-5.26,;.38,-4.01,;2.77,-4.86,;4.11,-5.63,;4.88,-4.3,;6.37,-3.9,;7.45,-4.99,;3.54,-3.53,)|

BDBM325504

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1C[C@H](CO)C1 |r,wU:26.30,(.75,4.49,;-.33,3.4,;-1.82,3.8,;-2.22,5.29,;-1.13,6.38,;-2.91,2.71,;-2.43,1.25,;-3.68,.34,;-4.93,1.25,;-4.45,2.71,;-3.68,-1.2,;-2.35,-1.97,;-2.35,-3.51,;-3.68,-4.28,;-5.01,-3.51,;-6.48,-3.98,;-7.38,-2.74,;-6.48,-1.49,;-5.01,-1.97,;-1.01,-4.28,;-1.01,-5.82,;.45,-6.29,;1.36,-5.05,;.45,-3.8,;2.9,-5.05,;3.99,-6.13,;5.07,-5.05,;6.61,-5.05,;7.38,-6.38,;3.99,-3.96,)|

BDBM325505

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@H]1C[C@@H](C1)C(N)=O |r,wU:26.32,wD:24.27,(-2.14,6.55,;-2.91,5.21,;-2.14,3.88,;-.6,3.88,;.17,5.21,;-2.91,2.55,;-2.43,1.08,;-3.68,.18,;-4.93,1.08,;-4.45,2.55,;-3.68,-1.36,;-2.35,-2.13,;-2.35,-3.67,;-3.68,-4.44,;-5.01,-3.67,;-6.48,-4.15,;-7.38,-2.9,;-6.48,-1.66,;-5.01,-2.13,;-1.01,-4.44,;-1.01,-5.98,;.45,-6.46,;1.36,-5.21,;.45,-3.97,;2.9,-5.21,;3.99,-6.3,;5.07,-5.21,;3.99,-4.12,;6.61,-5.21,;7.38,-6.55,;7.38,-3.88,)|

BDBM325506

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1C[C@@H](C1)C(N)=O |r,wU:26.32,(.75,4.49,;-.33,3.4,;-1.82,3.8,;-2.22,5.29,;-1.13,6.38,;-2.91,2.71,;-2.43,1.25,;-3.68,.34,;-4.93,1.25,;-4.45,2.71,;-3.68,-1.2,;-2.35,-1.97,;-2.35,-3.51,;-3.68,-4.28,;-5.01,-3.51,;-6.48,-3.98,;-7.38,-2.74,;-6.48,-1.49,;-5.01,-1.97,;-1.01,-4.28,;-1.01,-5.82,;.45,-6.29,;1.36,-5.05,;.45,-3.8,;2.9,-5.05,;3.99,-6.13,;5.07,-5.05,;3.99,-3.96,;6.61,-5.05,;7.38,-6.38,;7.38,-3.71,)|

BDBM325507

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1C[C@@H](C1)C(=O)N(C)C |r,wU:26.32,(-.02,5.16,;-1.1,4.07,;-2.59,4.47,;-2.99,5.96,;-1.9,7.05,;-3.68,3.38,;-3.2,1.92,;-4.45,1.01,;-5.7,1.92,;-5.22,3.38,;-4.45,-.53,;-3.12,-1.3,;-3.12,-2.84,;-4.45,-3.61,;-5.78,-2.84,;-7.25,-3.31,;-8.15,-2.07,;-7.25,-.82,;-5.78,-1.3,;-1.78,-3.61,;-1.78,-5.15,;-.32,-5.62,;.59,-4.38,;-.32,-3.13,;2.13,-4.38,;3.22,-5.47,;4.3,-4.38,;3.22,-3.29,;5.84,-4.38,;6.61,-3.05,;6.61,-5.71,;5.84,-7.05,;8.15,-5.71,)|

BDBM325509

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@H]1C[C@@H](C1)C(=O)NCCO |r,wU:26.32,wD:24.27,(-4.07,7.21,;-4.84,5.88,;-4.07,4.55,;-2.53,4.55,;-1.76,5.88,;-4.84,3.21,;-4.36,1.75,;-5.61,.84,;-6.85,1.75,;-6.38,3.21,;-5.61,-.7,;-4.27,-1.47,;-4.27,-3.01,;-5.61,-3.78,;-6.94,-3.01,;-8.4,-3.48,;-9.31,-2.24,;-8.4,-.99,;-6.94,-1.47,;-2.94,-3.78,;-2.94,-5.32,;-1.47,-5.79,;-.57,-4.55,;-1.47,-3.3,;.97,-4.55,;2.06,-5.64,;3.15,-4.55,;2.06,-3.46,;4.69,-4.55,;5.46,-3.21,;5.46,-5.88,;7,-5.88,;7.77,-7.21,;9.31,-7.21,)|

BDBM325510

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1C[C@@H](C1)C(=O)NCCO |r,wU:26.32,(-1.17,5.16,;-2.26,4.07,;-3.75,4.47,;-4.15,5.96,;-3.06,7.05,;-4.84,3.38,;-4.36,1.92,;-5.61,1.01,;-6.85,1.92,;-6.38,3.38,;-5.61,-.53,;-4.27,-1.3,;-4.27,-2.84,;-5.61,-3.61,;-6.94,-2.84,;-8.4,-3.31,;-9.31,-2.07,;-8.4,-.82,;-6.94,-1.3,;-2.94,-3.61,;-2.94,-5.15,;-1.47,-5.62,;-.57,-4.38,;-1.47,-3.13,;.97,-4.38,;2.06,-5.47,;3.15,-4.38,;2.06,-3.29,;4.69,-4.38,;5.46,-3.05,;5.46,-5.71,;7,-5.71,;7.77,-7.05,;9.31,-7.05,)|

BDBM325511

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CN(C1)C(=O)[C@H](C)O |r|

BDBM325512

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CN(C1)C(=O)CO

BDBM325513

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CN(C1)C(=O)[C@@H](C)O |r|

BDBM325514

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CN(C1)C(=O)C(C)(C)O

BDBM325515

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CN(C1)C(=O)C1(O)CC1

BDBM325516

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CN(C1)C(=O)C1C[C@H](O)C1 |r,wU:32.37,(2.16,9,;1.07,7.91,;-.41,8.31,;-.81,9.8,;.28,10.89,;-1.5,7.22,;-1.03,5.76,;-2.27,4.85,;-3.52,5.76,;-3.04,7.22,;-2.27,3.31,;-.94,2.54,;-.94,1,;-2.27,.23,;-3.61,1,;-5.07,.53,;-5.98,1.77,;-5.07,3.02,;-3.61,2.54,;.39,.23,;1.86,.71,;2.76,-.54,;1.86,-1.78,;.39,-1.31,;2.63,-3.12,;2.23,-4.6,;3.72,-5,;4.12,-3.51,;4.49,-6.34,;5.98,-6.73,;3.72,-7.67,;2.23,-8.07,;2.63,-9.56,;1.86,-10.89,;4.12,-9.16,)|

BDBM325517

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CN(C1)C(=O)C1C[C@H](O)C1 |r,wD:32.37,(2.16,9,;1.07,7.91,;-.41,8.31,;-.81,9.8,;.28,10.89,;-1.5,7.22,;-1.03,5.76,;-2.27,4.85,;-3.52,5.76,;-3.04,7.22,;-2.27,3.31,;-.94,2.54,;-.94,1,;-2.27,.23,;-3.61,1,;-5.07,.53,;-5.98,1.77,;-5.07,3.02,;-3.61,2.54,;.39,.23,;1.86,.71,;2.76,-.54,;1.86,-1.78,;.39,-1.31,;2.63,-3.12,;2.23,-4.6,;3.72,-5,;4.12,-3.51,;4.49,-6.34,;5.98,-6.73,;3.72,-7.67,;4.12,-9.16,;2.63,-9.56,;1.86,-10.89,;2.23,-8.07,)|

BDBM325518

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CN(C1)C(=O)CN1CC(O)C1

BDBM325519

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CN(C1)C(=O)CN1CCCC1

BDBM325520

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CN(C1)C(=O)C(=O)N(C)C

BDBM325521

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](N)C(C)(C)O)c1 |r|

BDBM325522

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC2(O)CCNCC2)c1

BDBM325523

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC2(O)CCN(CC2)C(C)=O)c1

BDBM325524

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CN(C1)C(=O)CN

BDBM325525

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CN(C1)C(=O)CNC

BDBM325526

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CCNC[C@H]1O |r|

BDBM325527

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@@H]1CCC[C@@H]1O |r|

BDBM325528

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@H]1CCC[C@H]1O |r|

BDBM325529

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC(C)(C)CO)c1

BDBM325530

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC2(CO)CC2)c1

BDBM325531

CCC(n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1)C(F)(F)F |r|

BDBM325532

C[C@H](CC(F)(F)F)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325534

CC[C@H](C1CCC1)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325535

CC[C@@H](C1CCC1)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325536

CCC(n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1)C(C)(F)F |r|

BDBM325538

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CCO)c1 |r|

BDBM325539

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](O)CCO)c1 |r|

BDBM325540

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@](C)(O)CO)c1 |r|

BDBM325541

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@](C)(O)CO)c1 |r|

BDBM325542

CCC([C@@H]1CC1(F)F)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325543

CCC(CC1CC1)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325545

CC[C@@H]1CCC[C@@H]1n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325546

CC[C@H]1CCC[C@H]1n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325547

CC[C@H](CC(F)(F)F)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325548

CC[C@@H](CC(F)(F)F)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325549

CC[C@H](CC(F)(F)F)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C(CO)CO |r|

BDBM325550

CC[C@@H](CC(F)(F)F)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C(CO)CO |r|

BDBM325551

CCC(C1CC1)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM325553

CCC(C1CC1)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C(CO)CO

BDBM325554

OC[C@H](O)Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)C(C1CC1)C1CC1 |r|

BDBM325555

C[C@@H]1CCC1n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM329918

Fc1cnc(Nc2ccnnc2)nc1N1C[C@@H]2CC[C@H](C1)N2C(=O)C1CC1 |r,THB:22:21:14.15.20:18.17|

BDBM329919

CCCNC(=O)c1cc(Nc2ncc(F)c(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)C2CC2)[nH]n1 |r,THB:25:24:17.18.23:21.20|

BDBM329920

NC(=O)c1cn2ccc(Nc3ncc(F)c(n3)N3C[C@@H]4CC[C@H](C3)N4C(=O)C3CC3)cc2n1 |r,THB:25:24:17.18.23:21.20|

BDBM329921

NS(=O)(=O)c1ccc(Nc2ncc(F)c(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)C2CC2)cn1 |r,THB:24:23:16.17.22:20.19|

BDBM329922

CCNC(=O)N1[C@H]2CC[C@@H]1CN(C2)c1ccnc(Nc2cn[nH]c2)n1 |r,THB:3:5:11.12.10:8.7|

BDBM329923

CNC(=O)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)C2CC2)cc1C |r,TLB:13:15:22:19.18|

BDBM329924

Cn1cc(cn1)Nc2nccc(n2)N3C[C@H]4CC[C@@H](C3)N4C(=O)[C@@H]5CC5(F)F

BDBM329925

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H]2CC2(F)F)cn1 |r,THB:19:18:11.12.17:15.14|

BDBM329926

CCNC(=O)c1ccc(Nc2ncc(F)c(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)C2CC2)cc1 |r,THB:25:24:17.18.23:21.20|

BDBM329927

CNC(=O)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2CC2(F)F)cc1Cl |r,THB:23:22:15.16.21:19.18|

BDBM329928

C[C@@H](CO)c1ccc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)C2CC2(F)F)cn1 |r,TLB:13:15:22:19.18|

BDBM329929

C[C@H](CO)c1ccc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)C2CC2(F)F)cn1 |r,TLB:13:15:22:19.18|

BDBM329930

CCNC(=O)c1ccc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)CC#N)cc1 |r,THB:24:23:16.17.22:20.19|

BDBM329931

CCNC(=O)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)C2CC2)cc1C |r,THB:24:23:16.17.22:20.19|

BDBM329932

Cc1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)C2CC2)cnc1C(N)=O |r,THB:19:18:11.12.17:15.14|

BDBM329933

OCCn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)C2CC2)cn1 |r,THB:21:20:13.14.19:17.16|

BDBM329934

O=C(N1[C@H]2CC[C@@H]1CN(C2)c1ccnc(Nc2cn[nH]c2)n1)c1ccno1 |r,THB:1:2:8.9.7:5.4|

BDBM329935

OCCc1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2CC2(F)F)cc1Cl |r,THB:22:21:14.15.20:18.17|

BDBM329936

OCCc1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2CC2(F)F)cc1F |r,THB:22:21:14.15.20:18.17|

BDBM329937

O[C@H]1CCN(C1)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2CC2(F)F)cc1F |r,THB:25:24:17.18.23:21.20|

BDBM329938

O[C@@H]1CCN(C1)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2CC2(F)F)cc1F |r,THB:25:24:17.18.23:21.20|

BDBM329939

OC1CN(C1)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2CC2(F)F)cc1F |r,THB:24:23:16.17.22:20.19|

BDBM329940

OCCOc1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2CC2(F)F)cc1Cl |r,THB:23:22:15.16.21:19.18|

BDBM329941

CCn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2C[C@H]2C#N)cn1 |r,THB:20:19:12.13.18:16.15|

BDBM329942

OCc1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2CC2(F)F)cc1F |r,THB:21:20:13.14.19:17.16|

BDBM329943

CC(C)(C#N)c1ccc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2CC2(F)F)cn1 |r,THB:24:23:16.17.22:20.19|

BDBM329944

CNC(=O)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2C[C@H]2C#N)cc1F |r,THB:23:22:15.16.21:19.18|

BDBM329945

CNC(=O)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)C2CC2(F)F)cc1F |r,THB:23:22:15.16.21:19.18|

BDBM329947

CNC(=O)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)C2CC2)cc1Cl |r,THB:23:22:15.16.21:19.18|

BDBM329948

CNC(=O)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2C[C@H]2C#N)cc1Cl |r,THB:23:22:15.16.21:19.18|

BDBM329949

CNC(=O)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2C[C@H]2C#N)cc1C |r,THB:23:22:15.16.21:19.18|

BDBM329950

CNC(=O)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2CC2(F)F)cc1C |r,THB:23:22:15.16.21:19.18|

BDBM329951

Cc1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)C2CC2(F)F)cnc1C(N)=O |r,THB:19:18:11.12.17:15.14|

BDBM329952

Cc1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2CC2(F)F)cnc1C(N)=O |r,THB:19:18:11.12.17:15.14|

BDBM329953

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)C2CC2)cn1 |r,THB:19:18:11.12.17:15.14|

BDBM329954

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2C[C@@H]2[N+]#[C-])cn1 |r,THB:19:18:11.12.17:15.14|

BDBM329955

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H]2C[C@H]2[N+]#[C-])cn1 |r,THB:19:18:11.12.17:15.14|

BDBM329956

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)C2CC(F)(F)C2)cn1 |r,THB:19:18:11.12.17:15.14|

BDBM329957

CNC(=O)c1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2CC2(F)F)cc(C)n1 |r,THB:22:21:14.15.20:18.17|

BDBM329958

CNC(=O)c1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2CC2(F)F)cc(CO)n1 |r,THB:22:21:14.15.20:18.17|

BDBM329959

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H]2C[C@H]2F)cn1 |r,THB:19:18:11.12.17:15.14|

BDBM329960

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2C[C@@H]2F)cn1 |r,THB:19:18:11.12.17:15.14|

BDBM329961

CNC(=O)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H]2C[C@@H]2F)cc1C |r,THB:23:22:15.16.21:19.18|

BDBM329962

CNC(=O)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2C[C@H]2F)cc1C |r,THB:23:22:15.16.21:19.18|

BDBM329963

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)C2(F)CC2)cn1 |r,THB:19:18:11.12.17:15.14|

BDBM329964

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)NCCC#N)cn1 |r,THB:19:18:11.12.17:15.14|

BDBM329965

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)Nc2ccc(cn2)C(F)(F)F)cn1 |r,THB:19:18:11.12.17:15.14|

BDBM329966

O=C(C1CC1)N1[C@H]2CC[C@@H]1CN(C2)c1ccnc(Nc2cn[nH]c2)n1 |r,THB:1:5:11.12.10:8.7|

BDBM329967

FC1(F)C[C@@H]1C(=O)N1[C@H]2CC[C@@H]1CN(C2)c1ccnc(Nc2cn[nH]c2)n1 |r,THB:5:7:13.14.12:10.9|

BDBM329968

FC1(F)C[C@H]1C(=O)N1[C@H]2CC[C@@H]1CN(C2)c1ccnc(Nc2cn[nH]c2)n1 |r,THB:5:7:13.14.12:10.9|

BDBM329969

O=C(C1CC1)N1[C@H]2CC[C@@H]1CN(C2)c1ccnc(Nc2cnsc2)n1 |r,THB:1:5:11.12.10:8.7|

BDBM329970

CNC(=O)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3Cc2ccno2)cc1C |r,THB:23:22:15.16.21:19.18|

BDBM329971

CNC(=O)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3CC2(C)COC2)cc1C |r,TLB:13:15:22:19.18|

BDBM329972

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3Cc2ccns2)cn1 |r,THB:19:18:11.12.17:15.14|

BDBM329973

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3Cc2ccno2)cn1 |r,THB:19:18:11.12.17:15.14|

BDBM329974

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3Cc2nccs2)cn1 |r,THB:19:18:11.12.17:15.14|

BDBM329975

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3Cc2cnoc2)cn1 |r,THB:19:18:11.12.17:15.14|

BDBM329976

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C2CC(C2)C#N)cn1 |r,wD:13.20,16.19,THB:19:18:11.12.17:15.14,(3.51,-2.94,;3.01,-4.39,;1.48,-4.94,;1.48,-6.48,;.15,-7.25,;-1.18,-6.48,;-2.52,-7.25,;-3.85,-6.48,;-3.85,-4.94,;-2.52,-4.17,;-1.18,-4.94,;-2.52,-2.63,;-1.18,-1.86,;-1.18,-.32,;-1.74,-1.29,;-3.28,-1.29,;-3.85,-.32,;-3.85,-1.86,;-2.52,.45,;-2.52,1.99,;-1.43,3.08,;-2.52,4.19,;-3.61,3.08,;-2.52,5.73,;-2.52,7.27,;2.95,-6.95,;3.85,-5.71,)|

BDBM329977

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C2CN(C2)S(C)(=O)=O)cn1 |r,TLB:9:11:18:15.14|

BDBM329978

CNC(=O)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3[C@H]2C[C@@H](C2)C#N)cc1C |r,wU:23.25,wD:17.24,20.23,25.30,THB:23:22:15.16.21:19.18,(4.67,-6.48,;4.67,-4.94,;3.33,-4.17,;3.33,-2.63,;2,-4.94,;.67,-4.17,;-.67,-4.94,;-.67,-6.48,;-2,-7.25,;-3.33,-6.48,;-4.67,-7.25,;-6,-6.48,;-6,-4.94,;-4.67,-4.17,;-3.33,-4.94,;-4.67,-2.63,;-3.33,-1.86,;-3.33,-.32,;-3.89,-1.29,;-5.43,-1.29,;-6,-.32,;-6,-1.86,;-4.67,.45,;-4.67,1.99,;-5.76,3.08,;-4.67,4.19,;-3.58,3.08,;-4.67,5.73,;-4.67,7.27,;.67,-7.25,;2.05,-6.51,;3.38,-7.28,)|

BDBM329979

CNC(=O)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3[C@@H]2C[C@@H](C2)C#N)cc1C |r,wU:23.25,25.30,wD:17.24,20.23,THB:23:22:15.16.21:19.18,(6,-4.17,;4.67,-4.94,;3.33,-4.17,;3.33,-2.63,;2,-4.94,;.67,-4.17,;-.67,-4.94,;-.67,-6.48,;-2,-7.25,;-3.33,-6.48,;-4.67,-7.25,;-6,-6.48,;-6,-4.94,;-4.67,-4.17,;-3.33,-4.94,;-4.67,-2.63,;-3.33,-1.86,;-3.33,-.32,;-3.89,-1.29,;-5.43,-1.29,;-6,-.32,;-6,-1.86,;-4.67,.45,;-4.67,1.99,;-3.58,3.08,;-4.67,4.19,;-5.76,3.08,;-4.67,5.73,;-4.67,7.27,;.67,-7.25,;2.05,-6.51,;3.38,-7.28,)|

BDBM329980

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C[C@H]2CC2(F)F)cn1 |r,THB:19:18:11.12.17:15.14|

BDBM329981

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C[C@@H]2CC2(F)F)cn1 |r,THB:19:18:11.12.17:15.14|

BDBM329982

FC1(F)CC1CN1[C@H]2CC[C@@H]1CN(C2)c1ccnc(Nc2cn[nH]c2)n1 |r,THB:5:6:12.13.11:9.8|

BDBM329984

CNC(=O)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3CC2CC2(F)F)cc1C |r,THB:23:22:15.16.21:19.18|

BDBM329986

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3CC2C[C@H]2C#N)cn1 |r,THB:19:18:11.12.17:15.14|

BDBM329987

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3CC2C[C@@H]2C#N)cn1 |r,THB:19:18:11.12.17:15.14|

BDBM329988

[C-]#[N+]C1(CN2[C@H]3CC[C@@H]2CN(C3)c2ccnc(Nc3cn[nH]c3)n2)CC1 |r,THB:12:10:4:7.6|

BDBM329989

CCNC(=O)c1ccc(Nc2ncc(F)c(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)C(F)(F)F)cc1C |r,THB:25:24:17.18.23:21.20|

BDBM329990

CCNC(=O)c1ccc(Nc2ncc(F)c(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)cc1C |r,THB:25:24:17.18.23:21.20|

BDBM329991

CCNC(=O)N1[C@H]2CC[C@@H]1CN(C2)c1ccnc(Nc2cnsc2)n1 |r,THB:3:5:11.12.10:8.7|

BDBM329992

CCNC(=O)N1[C@H]2CC[C@@H]1CN(C2)c1ccnc(Nc2cnc(C(=O)NC)c(Cl)c2)n1 |r,THB:3:5:11.12.10:8.7|

BDBM329993

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(N)=O)cn1 |r,THB:19:18:11.12.17:15.14|

BDBM329994

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3S(C)(=O)=O)cn1 |r,TLB:9:11:18:15.14|

BDBM329995

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3c2ncc(o2)[N+]#[C-])cn1 |r,THB:19:18:11.12.17:15.14|

BDBM329996

N#CCCN1[C@H]2CC[C@@H]1CN(C2)c1ccnc(Nc2cn[nH]c2)n1 |r,THB:3:4:10.11.9:7.6|

BDBM329997

CC(CC#N)N1[C@H]2CC[C@@H]1CN(C2)c1ccnc(Nc2cnn(C)c2)n1 |r,THB:1:5:11.12.10:8.7|

BDBM329999

CC(CC#N)N1[C@H]2CC[C@@H]1CN(C2)c1ccnc(Nc2cn[nH]c2)n1 |r,THB:1:5:11.12.10:8.7|

BDBM330000

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C2(C[N+]#[C-])CN(C2)S(C)(=O)=O)cn1 |r,TLB:9:11:18:15.14|

BDBM330001

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C2(C[N+]#[C-])COC2)cn1 |r,THB:19:18:11.12.17:15.14|

BDBM330002

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)NCC#N)cn1 |r,THB:19:18:11.12.17:15.14|

BDBM330003

CCNC(=O)N1[C@H]2CC[C@@H]1CN(C2)c1ccnc(Nc2cnn(C)c2)n1 |r,THB:3:5:11.12.10:8.7|

BDBM330004

CCNC(=O)N1[C@H]2CC[C@@H]1CN(C2)c1ccnc(Nc2cnc(C(=O)NC)c(F)c2)n1 |r,THB:3:5:11.12.10:8.7|

BDBM330005

CC(C)NC(=O)N1[C@H]2CC[C@@H]1CN(C2)c1ccnc(Nc2cnn(C)c2)n1 |r,THB:4:6:12.13.11:9.8|

BDBM330006

CNC(=O)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)NCC(F)(F)F)cc1C |r,THB:23:22:15.16.21:19.18|

BDBM330007

CNC(=O)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)NCC#N)cc1C |r,THB:23:22:15.16.21:19.18|

BDBM330008

CCNC(=O)N1[C@H]2CC[C@@H]1CN(C2)c1ccnc(Nc2cnc(C(=O)NC)c(C)c2)n1 |r,THB:3:5:11.12.10:8.7|

BDBM330009

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3c2cc(ccn2)[N+]#[C-])cn1 |r,THB:19:18:11.12.17:15.14|

BDBM330010

C[C@@H]1[C@H]2[C@@]1(CN(C2)c3c(cnc(n3)Nc4cnn(c4)C)F)NC(=O)[C@@H]5CC5(F)F

BDBM330011

C[C@@H]1[C@@H]2CN(C[C@]12NC(=O)[C@H]1CC1(F)F)c1nc(Nc2cnn(C)c2)ncc1F |r|

BDBM330012

C[C@@H]1[C@@H]2CN(C[C@]12NC(=O)[C@@H]1C[C@H]1[N+]#[C-])c1nc(Nc2cnn(C)c2)ncc1F |r|

BDBM330013

C[C@H]1[C@H]2CN(C[C@@]12NC(=O)[C@@H]1CC1(F)F)c1nc(Nc2cnn(C)c2)ncc1F |r|

BDBM330014

C[C@H]1[C@H]2CN(C[C@@]12NC(=O)[C@H]1CC1(F)F)c1nc(Nc2cnn(C)c2)ncc1F |r|

BDBM330015

C[C@@H]1[C@@H]2CN(C[C@]12NC(=O)[C@H]1C[C@@H]1[N+]#[C-])c1nc(Nc2ccc(OCCO)nc2)ncc1C |r|

BDBM330016

C[C@@H]1[C@@H]2CN(C[C@]12NC(=O)[C@@H]1CC1(F)F)c1nc(Nc2cnn(c2)C2COC2)ncc1F |r|

BDBM330017

CNC(=O)c1ncc(Nc2ncc(F)c(n2)N2C[C@H]3[C@@H](C)[C@]3(C2)NC(=O)C2CC2)cc1C |r|

BDBM330018

CNC(=O)c1ncc(Nc2ncc(F)c(n2)N2C[C@@H]3[C@H](C)[C@@]3(C2)NC(=O)C2CC2)cc1C |r|

BDBM330019

C[C@@H]1[C@@H]2CN(C[C@]12NC(=O)C1CC1)c1nc(Nc2ccc(CCO)nc2)ncc1F |r|

BDBM330020

C[C@H](CO)c1ccc(Nc2ncc(F)c(n2)N2C[C@H]3[C@@H](C)[C@]3(C2)NC(=O)C2CC2)cn1 |r|

BDBM330021

C[C@@H](CO)c1ccc(Nc2ncc(F)c(n2)N2C[C@H]3[C@@H](C)[C@]3(C2)NC(=O)C2CC2)cn1 |r|

BDBM330022

C[C@@H]1[C@@H]2CN(C[C@]12NC(=O)C1CC1)c1nc(Nc2cnc(CO)c(Cl)c2)ncc1F |r|

BDBM330023

C[C@H](O)c1ncc(Nc2ncc(F)c(n2)N2C[C@H]3[C@@H](C)[C@]3(C2)NC(=O)C2CC2)cc1Cl |r|

BDBM330024

OCCn1cc(Nc2ncc(Cl)c(n2)N2CC3C[C@]3(C2)NC(=O)C2CC2)cn1 |r|

BDBM330025

OCCn1cc(Nc2ncc(Cl)c(n2)N2CC3C[C@@]3(C2)NC(=O)C2CC2)cn1 |r|

BDBM330026

Cn1cc(Nc2ncc(F)c(n2)N2C[C@@]3(CO)C[C@]3(C2)NC(=O)[C@@H]2CC2(F)F)cn1 |r|

BDBM330027

Cn1cc(Nc2ncc(F)c(n2)N2C[C@@]3(CO)C[C@]3(C2)NC(=O)[C@@H]2C[C@H]2[N+]#[C-])cn1 |r|

BDBM330028

CCNC(=O)c1ccc(Nc2ncc(F)c(n2)N2CC3CC(C2)N3C(=O)C(C)(F)F)cc1C |THB:15:17:23:20|

BDBM330029

CCNC(=O)c1ccc(Nc2ncc(F)c(n2)N2CC3CC(C2)N3C(=O)C(C)(C)F)cc1C |THB:15:17:23:20|

BDBM330030

CCNC(=O)c1ccc(Nc2nccc(n2)N2CC3CC(C2)N3C(=O)C2CC2)cc1C

BDBM330031

CCNC(=O)c1ccc(Nc2nccc(n2)N2CC3CC(C2)N3C(=O)C(C)(F)F)cc1 |THB:14:16:22:19|

BDBM330032

CCNC(=O)c1ccc(Nc2nccc(n2)N2CC3CC(C2)N3C(=O)C(F)(F)F)cc1C

BDBM330033

CCNC(=O)c1ccc(Nc2ncc(F)c(n2)N2CC3CC(C2)N3C(=O)C(F)(F)F)cc1C

BDBM330034

NC(=O)c1ncc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2CC2(F)F)cc1F |r,THB:22:21:14.15.20:18.17|

BDBM332765

CCOC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2ccccc2Cl)cc1

BDBM332766

OC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332767

CCOC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332768

CCOC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2Cl)cc1

BDBM332769

CCOC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(Cl)cccc2Cl)cc1

BDBM332770

Clc1cccc(Cl)c1-c1nc2CNC(=O)c2c(Nc2ccc(COC=O)cc2)n1

BDBM332771

Clc1ccccc1-c1nc2CNC(=O)c2c(Nc2ccc(COC=O)cc2)n1

BDBM332772

NC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2ccccc2Cl)cc1

BDBM332773

OC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(Cl)cc(cc2Cl)C#N)cc1

BDBM332774

OC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2Cl)cc1

BDBM332775

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(CC(=O)NC3CCNCC3)cc2)n1

BDBM332776

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(CC(=O)NC3CNC3)cc2)n1

BDBM332777

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(CC(=O)NCC3CCNCC3)cc2)n1

BDBM332778

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(CC(=O)NC3CC4(CNC4)C3)cc2)n1

BDBM332779

OC[C@H]1CCCN1C(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332780

OC[C@@H]1CCCN1C(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332781

OC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cn1

BDBM332782

COC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cn1

BDBM332783

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(CC(=O)NC3CCNCC3)nc2)n1

BDBM332784

CCNC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2ccccc2Cl)cc1

BDBM332785

Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332786

CN(C1CCNCC1)C(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332787

CCNC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cn1

BDBM332788

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(CC(=O)N[C@@H]3CCCNC3)cc2)n1 |r|

BDBM332789

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(CC(=O)N3CC4(COC4)C3)cc2)n1

BDBM332790

C[C@H](CO)NC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332791

C[C@H]1COCCN1C(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332792

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(CC(=O)NC3CCOCC3)cc2)n1

BDBM332793

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(CC(=O)N3CCOCC3)cc2)n1

BDBM332794

CN1CCN(CC1)C(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332795

OC[C@@H]1CCCN1C(=O)Cn1cc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cn1 |r|

BDBM332796

CCNC(=O)Cn1cc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cn1

BDBM332797

C[C@H](CO)NC(=O)Cn1cc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cn1 |r|

BDBM332798

OC(=O)Cn1cc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cn1

BDBM332799

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(CC(=O)NCC3CNC3)cc2)n1

BDBM332800

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(CC(=O)N[C@@H]3CCNC3)cc2)n1 |r|

BDBM332801

C[C@@H](CO)NC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332802

C[C@H](O)CNC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332803

CC(C)(O)CNC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332804

C[C@@H](O)CNC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332805

FC(F)CN1CCN(CC1)C(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332806

OCCNC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332807

CCNC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332809

OC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2C(F)(F)F)cc1

BDBM332811

Fc1cccc(c1-c1nc2CNC(=O)c2c(Nc2ccc(CC(=O)NC3CCNCC3)cc2)n1)C(F)(F)F

BDBM332812

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(CC(=O)N3CCS(=O)(=O)CC3)cc2)n1

BDBM332813

OC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cncc2F)cc1

BDBM332814

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)[C@H]2CCNC2=O)n1 |r|

BDBM332815

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)[C@@H]2CCNC2=O)n1 |r|

BDBM332816

CCNC(=O)Cc1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332817

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)[C@H]2CCNC2=O)c2C(=O)NCc2n1 |r|

BDBM332818

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)[C@@H]2CCNC2=O)c2C(=O)NCc2n1 |r|

BDBM332819

CC(C)(C(O)=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332820

COc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332821

COC(=O)[C@@H]1COCCN1C(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332822

OC(=O)[C@@H]1COCCN1C(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332823

Fc1cccc(Cl)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)C2CCNC2=O)n1

BDBM332824

Fc1cccc(Cl)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)[C@H]2CCNC2=O)n1 |r|

BDBM332825

Fc1cccc(Cl)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)[C@@H]2CCNC2=O)n1 |r|

BDBM332826

COCCC1(CCNC1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332827

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)C2CCN(C3CCC3)C2=O)n1

BDBM332828

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)[C@H]2CCN(C3CCC3)C2=O)n1 |r|

BDBM332829

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)[C@@H]2CCN(C3CCC3)C2=O)n1 |r|

BDBM332830

CCNC(=O)C(C)(C)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332831

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)C2CCN(CCN3CCOCC3)C2=O)n1

BDBM332832

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)[C@H]2CCN(CCN3CCOCC3)C2=O)n1 |r|

BDBM332833

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)[C@@H]2CCN(CCN3CCOCC3)C2=O)n1 |r|

BDBM332834

CC1(CCN(C2CCOCC2)C1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332835

C[C@]1(CCN(C2CCOCC2)C1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332836

C[C@@]1(CCN(C2CCOCC2)C1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332837

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)C(=O)NCCN2CCOCC2)n1

BDBM332838

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(Cn3ccnn3)cc2)n1

BDBM332839

COC(=O)[C@H]1C[C@@H](C1)Nc1nc(nc2CNC(=O)c12)-c1c(F)cccc1F |r,wU:4.3,wD:6.8,(-5.61,2.23,;-5.61,.69,;-4.28,-.08,;-4.28,-1.62,;-2.94,.69,;-2.55,2.18,;-1.06,1.78,;-1.46,.29,;.28,2.55,;1.61,1.78,;1.61,.24,;2.94,-.53,;4.28,.24,;4.28,1.78,;5.42,2.81,;4.8,4.22,;3.26,4.06,;2.17,5.15,;2.94,2.55,;2.94,-2.07,;4.28,-2.84,;5.61,-2.07,;4.28,-4.38,;2.94,-5.15,;1.61,-4.38,;1.61,-2.84,;.28,-2.07,)|

BDBM332840

OC(=O)[C@H]1C[C@@H](C1)Nc1nc(nc2CNC(=O)c12)-c1c(F)cccc1F |r,wU:3.2,wD:5.7,(-5.61,.69,;-4.28,-.08,;-4.28,-1.62,;-2.94,.69,;-2.55,2.18,;-1.06,1.78,;-1.46,.29,;.28,2.55,;1.61,1.78,;1.61,.24,;2.94,-.53,;4.28,.24,;4.28,1.78,;5.42,2.81,;4.8,4.22,;3.26,4.06,;2.17,5.15,;2.94,2.55,;2.94,-2.07,;4.28,-2.84,;5.61,-2.07,;4.28,-4.38,;2.94,-5.15,;1.61,-4.38,;1.61,-2.84,;.28,-2.07,)|

BDBM332842

CCNC(=O)[C@H]1C[C@@H](C1)Nc1nc(nc2CNC(=O)c12)-c1c(F)cccc1F |r,wU:5.4,wD:7.9,(-6.28,-1.62,;-6.28,-.08,;-4.94,.69,;-3.61,-.08,;-3.61,-1.62,;-2.28,.69,;-1.88,2.18,;-.39,1.78,;-.79,.29,;.94,2.55,;2.28,1.78,;2.28,.24,;3.61,-.53,;4.94,.24,;4.94,1.78,;6.09,2.81,;5.46,4.22,;3.93,4.06,;2.84,5.15,;3.61,2.55,;3.61,-2.07,;4.94,-2.84,;6.28,-2.07,;4.94,-4.38,;3.61,-5.15,;2.28,-4.38,;2.28,-2.84,;.94,-2.07,)|

BDBM332843

COC(=O)Cc1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332844

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)C2CCNC2=O)c2C(=O)NCc2n1

BDBM332845

Fc1cccc(F)c1-c1cc(Nc2ccc(OCCN3CCC3)cn2)c2C(=O)NCc2n1

BDBM332846

Fc1cccc(F)c1-c1cc(Nc2ccc(NCCN3CCC(F)(F)CC3)cn2)c2C(=O)NCc2n1

BDBM332847

CCNC(=O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332848

CC1(O)CCN(CC1)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332849

CC(C)NC(=O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332850

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)C(=O)NC2CCOCC2)c2C(=O)NCc2n1

BDBM332851

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)C(=O)NCC(F)(F)F)c2C(=O)NCc2n1

BDBM332852

COCCNC(=O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332853

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CCC(CC2)N2CCOCC2)c2C(=O)NCc2n1

BDBM332854

N[C@H]1CCCN(C1)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1 |r|

BDBM332855

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CC3(COC3)C2)c2C(=O)NCc2n1

BDBM332856

COc1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2Cl)nc1

BDBM332857

CCNC(=O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2Cl)nc1

BDBM332858

OC1CCN(CC1)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332859

Fc1cccc(F)c1-c1cc(Nc2ccc(OCCN3CCOCC3)cn2)c2C(=O)NCc2n1

BDBM332860

OCCN1CCC(C1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332861

CN1CCC(C)(C1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332862

CN1CC[C@](C)(C1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332863

CN1CC[C@@](C)(C1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332864

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)C2CCCNC2=O)n1

BDBM332865

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)[C@H]2CCCNC2=O)n1 |r|

BDBM332866

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)[C@@H]2CCCNC2=O)n1 |r|

BDBM332867

OC(=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332868

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)C(=O)N2CC3(COC3)C2)n1

BDBM332869

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)C(=O)N2CCC2)n1

BDBM332870

N[C@@H]1CCCN(C1)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1 |r|

BDBM332871

Cn1cc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cn1

BDBM332872

CC(C)(O)CN1CCC(C1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332873

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CCNCC2)c2C(=O)NCc2n1

BDBM332874

CN1CCN(CC1)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332875

OCCNC(=O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332876

CC(C)(C)NC(=O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332877

COC(=O)Cc1ncc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cn1

BDBM332878

COc1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332879

OC1CN(C1)C(=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332880

CCNC(=O)Cc1ncc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cn1

BDBM332881

COc1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1OC

BDBM332882

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CCOCC2)c2C(=O)NCc2n1

BDBM332883

CC1(NC(=O)NC1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332884

C[C@]1(NC(=O)NC1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332885

C[C@@]1(NC(=O)NC1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332886

CCC1(CCNC1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332887

CC[C@]1(CCNC1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332888

CC[C@@]1(CCNC1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332889

CCOC(=O)C(C)(C)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332890

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccccc2)n1

BDBM332891

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(Cl)cc2)n1

BDBM332892

CC(C)Oc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332893

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CCC(F)(F)CC2)c2C(=O)NCc2n1

BDBM332894

COc1ccc(Nc2nc(nc3CNC(=O)c23)N2[C@@H](C)CCC[C@H]2C)cc1 |r|

BDBM332895

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(OC(F)(F)F)cc2)n1

BDBM332896

COCCOc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332897

OC(=O)Cc1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332898

CN1CC2(C1)CN(C2)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332899

COC(=O)C(C)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332900

CC(C(O)=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332901

C[C@@H](C(O)=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332902

C[C@H](C(O)=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332903

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)C2SC(=O)NC2=O)n1

BDBM332904

CN(CC(C)(C)O)C(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332905

OC(=O)[C@H]1COCCN1C(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332906

CCNC(=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332907

CC(C)(C(=O)N1CCCC1)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332908

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)C2CCCCC2)n1

BDBM332909

CC(C(=O)N1CCCCC1)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332910

CCNC(=O)Cc1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2Cl)nc1

BDBM332911

COC(=O)Cc1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2Cl)nc1

BDBM332912

COC(=O)C1COCCN1C(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332913

OC(=O)C1COCCN1C(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332914

CCNC(=O)C(=C)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332915

Fc1cccc(Cl)c1-c1cc(Nc2ccc(cn2)N2CCCC2)c2C(=O)NCc2n1

BDBM332916

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CCCC2)c2C(=O)NCc2n1

BDBM332917

C[C@H](C(=O)N1CCCCC1)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332918

C[C@@H](C(=O)N1CCCCC1)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332919

CCNC(=O)Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cncc2F)cc1

BDBM332920

CN1CCN(C)C(C)(C1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332921

CN1CCN(C)[C@@](C)(C1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332922

CN1CCN(C)[C@](C)(C1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332923

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)C(=O)N2CCOCC2)c2C(=O)NCc2n1

BDBM332924

CC1(C)CC(C(=O)N1)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332925

OC1CN(C1)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332926

CN1CCNC(C)(C1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332927

CN1CCN[C@@](C)(C1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332928

CN1CCN[C@](C)(C1=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332929

CC1(C)C[C@H](C(=O)N1)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332930

CC1(C)C[C@@H](C(=O)N1)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332931

CN1C(=O)C(C)(CC1(C)C)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332932

CN1C(=O)[C@@](C)(CC1(C)C)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332933

CN1C(=O)[C@](C)(CC1(C)C)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332934

CN1CCNC(C)(C1=O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332935

CN1CCN[C@@](C)(C1=O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1 |r|

BDBM332936

CN1CCN[C@](C)(C1=O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1 |r|

BDBM332937

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)C(=O)NCC2CC2)c2C(=O)NCc2n1

BDBM332938

CC(C)(C)N1CCN(CC1)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332939

CC1(O)CN(C1)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332940

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CC(F)(F)C2)c2C(=O)NCc2n1

BDBM332941

COc1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332942

Fc1cccc(F)c1-c1cc(Nc2ccc(cc2)C(=O)N2CCOCC2)c2C(=O)NCc2n1

BDBM332943

CC(C)NC(=O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332944

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CCC3(CC3)C2)c2C(=O)NCc2n1

BDBM332945

Fc1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332946

Fc1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332947

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)S(=O)(=O)C(F)(F)F)n1

BDBM332948

CC(=O)Nc1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332949

Fc1cccc(F)c1-c1cc(Nc2ccc(nc2)N2CCOCC2)c2C(=O)NCc2n1

BDBM332950

COc1ccc(Nc2cc(nc3C(C)NC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332951

COc1ccc(Nc2cc(nc3[C@@H](C)NC(=O)c23)-c2c(F)cccc2F)nc1 |r|

BDBM332952

COc1ccc(Nc2cc(nc3[C@H](C)NC(=O)c23)-c2c(F)cccc2F)nc1 |r|

BDBM332953

CC(C)N1CCN(C(=O)C1)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332954

CC(C)N1CCN(CC1)C(=O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332955

CC1COCCN1c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332956

C[C@H]1COCCN1c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1 |r|

BDBM332957

C[C@@H]1COCCN1c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1 |r|

BDBM332958

FC(F)CN1CCN(CC1)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332959

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CCOCC2=O)c2C(=O)NCc2n1

BDBM332960

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)C2=CCOCC2)c2C(=O)NCc2n1 |t:20|

BDBM332961

NC(=O)c1cc(F)c(c(F)c1)-c1cc(Nc2ccc(cn2)N2CCOCC2)c2C(=O)NCc2n1

BDBM332962

OC1(CCOCC1)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332963

CC1(C)CCN(CC1)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332964

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CCCOCC2)c2C(=O)NCc2n1

BDBM332965

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(cn2)N2CCOCC2)c1F |(6.67,-2.07,;5.33,-2.84,;5.33,-4.38,;4,-5.15,;2.67,-4.38,;2.67,-2.84,;1.33,-2.07,;4,-2.07,;4,-.53,;5.33,.24,;5.33,1.78,;6.48,2.81,;5.85,4.22,;4.32,4.06,;3.23,5.15,;4,2.55,;2.67,1.78,;1.33,2.55,;,1.78,;-1.33,2.55,;-2.67,1.78,;-2.67,.24,;-1.33,-.53,;,.24,;-4,-.53,;-5.33,.24,;-6.67,-.53,;-6.67,-2.07,;-5.33,-2.84,;-4,-2.07,;2.67,.24,;1.33,-.53,)|

BDBM332966

CC1(COC1)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332967

CC(C)N1CCN(CC1)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332968

Fc1cccc(F)c1-c1cc(Nc2ccc(cc2)C(=O)N2CCCCC2)c2C(=O)NCc2n1

BDBM332969

COc1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2C#N)nc1

BDBM332970

CCN(CC)C(=O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332971

CCNC(=O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)cn1

BDBM332972

C[C@H]1CCC[C@@H](C)N1c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1 |r|

BDBM332973

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CCN(CCC(F)(F)F)CC2)c2C(=O)NCc2n1

BDBM332974

C[C@@H]1COC[C@@H](C)N1c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1 |r|

BDBM332975

C[C@H]1COC[C@H](C)N1c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1 |r|

BDBM332976

C[C@@H]1CCC[C@@H](C)N1c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1 |r|

BDBM332977

CC1(C)CN(CCC1O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332978

CC1(C)CN(CC[C@@H]1O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1 |r|

BDBM332979

CC1(C)CN(CC[C@H]1O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1 |r|

BDBM332980

OC1CCCN(C1)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332981

O[C@H]1CCCN(C1)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1 |r|

BDBM332982

O[C@@H]1CCCN(C1)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1 |r|

BDBM332983

CC1(C)CCC(=O)N1c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332984

CC1(C)OCCN(C1=O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332985

CN(c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1)C(C)(C)C

BDBM332986

CC1(O)CCN(CC1)C(=O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM332987

Fc1cccc(F)c1-c1cc(Nc2ccc(NC3CCC3)cn2)c2C(=O)NCc2n1

BDBM332988

FC(F)S(=O)(=O)Nc1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332989

CC(C)(C)Nc1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332990

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2C3CC2COC3)c2C(=O)NCc2n1

BDBM332991

Fc1cccc(F)c1-c1cc(Nc2ccc(nc2)C(=O)N2CCOCC2)c2C(=O)NCc2n1

BDBM332992

Fc1cccc(C#N)c1-c1cc(Nc2ccc(cn2)N2CCOCC2)c2C(=O)NCc2n1

BDBM332993

CCNC(=O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2C#N)nc1

BDBM332994

Fc1cccc(F)c1-c1cc(Nc2ccc(cc2)C(=O)N2CCC(F)(F)CC2)c2C(=O)NCc2n1

BDBM332995

CC1(C)CCCC(=O)N1c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM332996

C[C@@H]1COC[C@@H](C)N1C(=O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM332997

CCNC(=O)c1cnc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1F

BDBM332998

Fc1cccc(C#N)c1-c1cc(Nc2ccc(cc2)C(=O)N2CCOCC2)c2C(=O)NCc2n1

BDBM332999

CC1CC(O)CC(C)N1c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1

BDBM333000

Cc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1F

BDBM333120

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2C[C@H](N(Cc2[nH]1)C(C)C)C(=O)N1CC(C1)N(C)C |r|

BDBM333122

CCCN1Cc2[nH]c(nc2C[C@H]1C(=O)N1CC(C)(C1)N(C)C)-c1n[nH]c2cc(ccc12)-c1cc(F)c(O)cc1CC |r|

BDBM764863

Cc1cnc(Nc2ccc(OCCOc3ccc(/N=N/c4ccc(C(=O)NCCC(=O)O)cc4)cc3C(=O)O)cc2)nc1Nc1cccc(S(=O)(=O)NC(C)(C)C)c1

BDBM764864

Cc1cnc(Nc2ccc(OCCO)cc2)nc1Nc1cccc(S(=O)(=O)NC(C)(C)C)c1

BDBM50332294

Cc1cnc(nc1Nc2cccc(c2)S(=O)(=O)NC(C)(C)C)Nc3ccc(cc3)OCCN4CCCC4

BDBM350089

CCCN1Cc2[nH]c(nc2C[C@H]1C(=O)N1C[C@@H]2C[C@H]1CN2C)-c1n[nH]c2cc(ccc12)-c1cc(F)c(O)cc1CC |r|

BDBM350090

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2C[C@H](N(Cc2[nH]1)C(C)C)C(=O)N1CC[C@@H](C1)N(C)C |r|

BDBM350094

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CC(NCc2[nH]1)C(=O)N1CCN(CC1)C(C)C

BDBM350095

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2C[C@H](N(C)Cc2[nH]1)C(=O)N1CCN(CC1)C(C)C |r|

BDBM350096

CCCN1Cc2[nH]c(nc2C[C@H]1C(=O)N1CCN(CC1)C(C)(C)C)-c1n[nH]c2cc(ccc12)-c1cc(F)c(O)cc1CC |r|

BDBM350098

CCCN1Cc2[nH]c(nc2C[C@H]1CN1CC[C@@H](C1)C(C)C)-c1n[nH]c2cc(ccc12)-c1cc(F)c(O)cc1CC |r|

BDBM354217

Cc1ncc(F)cc1C1CCCN1c1ccn2ncc(C(=O)NC3CC3)c2n1

BDBM357013

C(Nc1nc(nc2cccc(-c3ccccc3)c12)-c1cncnc1)c1ccccn1

BDBM50239227

NS(=O)(=O)c1cncc(c1)-c1nc(NCc2ccccn2)c2c(cccc2n1)-c1ccccc1

BDBM357015

Clc1nc(NCc2ccccn2)c2c(cccc2n1)-c1ccccc1

BDBM362184

CC(=O)N1CCN(CC1)c1ccc(Nc2cc(NCc3ccccc3)c(nn2)C(N)=O)cc1

BDBM362204

CC(=O)N1CCN(CC1)c1ccc(Nc2cc(NCc3ccccc3F)c(nn2)C(N)=O)cc1

BDBM362207

CC(=O)N1CCN(CC1)c1ccc(Nc2cc(NCc3cccc(F)c3)c(nn2)C(N)=O)cc1

BDBM362208

CC(=O)N1CCN(CC1)c1ccc(Nc2cc(NCc3cc(F)cc(F)c3)c(nn2)C(N)=O)cc1

BDBM362211

CC(=O)N1CCN(CC1)c1ccc(Nc2cc(NCc3cccs3)c(nn2)C(N)=O)cc1

BDBM362213

CC(=O)N1CCN(CC1)c1ccc(Nc2cc(NCc3ccccc3C)c(nn2)C(N)=O)cc1

BDBM362221

CCC(=O)N1CCN(CC1)c1ccc(Nc2cc(NCc3ccccc3F)c(nn2)C(N)=O)cc1

BDBM362226

CCC(=O)N1CCN(CC1)c1ccc(Nc2cc(NCc3c(F)cccc3F)c(nn2)C(N)=O)cc1

BDBM362238

Cc1cc(Nc2cc(NCc3cccc(F)c3F)c(nn2)C(N)=O)ccc1C(=O)N1CCCC1

BDBM362260

NC(=O)c1nnc(Nc2cccc(OCCN3CCCC3)c2)cc1NCc1cccc(F)c1

BDBM362262

CC(=O)N1CCN(CC1)c1ccc(Nc2cc(NC3(CC3)c3ccccc3)c(nn2)C(N)=O)cc1

BDBM362263

COc1cccc(CNc2cc(Nc3ccc(cc3)N3CCN(CC3)C(C)=O)nnc2C(N)=O)c1

BDBM362264

CN(C)C(=O)c1ccc(Nc2cc(NCc3cccc(F)c3)c(nn2)C(N)=O)cc1

BDBM362265

CN(C)C(=O)c1ccc(Nc2cc(NCc3cccc(F)c3)c(nn2)C(N)=O)cc1C

BDBM362266

Cc1cc(Nc2cc(NCc3cccc(F)c3)c(nn2)C(N)=O)ccc1C(=O)N1CCCC1

BDBM362270

CC(=O)Nc1cccc(Nc2cc(NCc3cccc(F)c3)c(nn2)C(N)=O)c1

BDBM362271

Cn1cc(Nc2cc(NCc3cccc(F)c3)c(nn2)C(N)=O)cn1

BDBM362298

CS(=O)(=O)Cc1ccc(Nc2cc(NCc3cccc(F)c3F)c(nn2)C(N)=O)cc1

BDBM362309

CC(=O)N1CCN(CC1)c1ccc(Nc2cc(NCc3cccc4ccsc34)c(nn2)C(N)=O)cc1

BDBM362310

NC(=O)c1nnc(Nc2ccc(cc2)N2CCNCC2)cc1NCc1cccc2ccsc12

BDBM364373

COc1cc(ccc1Nc1ncc(Cl)c(NCc2cccc(NC(=O)C=C)c2)n1)N1CCN(CCNC(=O)CC2[C@H]3CC4C[C@@H](C[C@@H]2C4)C3)CC1 |r,wU:46.50,40.43,44.46,THB:41:42:45:39.40.48,43:42:39:44.45.48,(-2,-2.7,;-2,-1.16,;-.67,-.39,;.67,-1.16,;2,-.39,;2,1.15,;.67,1.92,;-.67,1.15,;-2,1.92,;-3.33,1.15,;-3.33,-.39,;-4.67,-1.16,;-6,-.39,;-7.34,-1.15,;-6,1.15,;-7.34,1.92,;-8.67,1.15,;-10,1.92,;-10,3.46,;-11.34,4.23,;-12.67,3.46,;-12.67,1.92,;-14,1.15,;-15.34,1.92,;-15.34,3.46,;-16.67,1.15,;-18,1.92,;-11.34,1.15,;-4.67,1.93,;3.33,-1.16,;3.33,-2.7,;4.67,-3.47,;6,-2.7,;7.34,-3.47,;8.67,-2.7,;10,-3.47,;11.34,-2.7,;11.34,-1.16,;12.67,-3.47,;14,-2.7,;14,-1.16,;15.34,-.39,;16.67,-1.16,;18,-1.93,;18,-3.47,;16.67,-4.23,;15.34,-3.46,;16.67,-2.7,;16.23,-1.83,;6,-1.16,;4.67,-.39,)|

BDBM364403

COc1cc(ccc1Nc1ncc(Cl)c(NCc2cccc(NC(=O)C=C)c2)n1)N1CCN(CCCNC(=O)CC2[C@H]3C[C@@H]4C[C@H](C[C@@H]2C4)C3)CC1 |r,wD:41.54,45.53,47.49,43.46,THB:46:45:40.47.48:42,44:45:40:48.43.42,(2.67,-1.92,;2.67,-.38,;1.33,.39,;,-.38,;-1.33,.39,;-1.33,1.93,;,2.7,;1.33,1.93,;2.67,2.7,;4,1.93,;4,.39,;5.33,-.38,;6.67,.39,;8,-.38,;6.67,1.93,;8,2.7,;9.34,1.93,;10.67,2.7,;10.67,4.24,;12,5.01,;13.34,4.24,;13.34,2.7,;14.67,1.93,;16,2.7,;16,4.24,;17.34,1.93,;18.67,2.7,;12,1.93,;5.33,2.7,;-2.67,-.38,;-2.67,-1.92,;-4,-2.69,;-5.33,-1.92,;-6.67,-2.69,;-8,-1.92,;-9.34,-2.69,;-10.67,-1.92,;-12,-2.69,;-12,-4.23,;-13.34,-1.92,;-14.67,-2.69,;-14.67,-4.23,;-16.4,-3.74,;-18.67,-1.92,;-18.67,-3.46,;-17.34,-4.23,;-17.34,-2.69,;-16,-1.92,;-17.34,-1.15,;-16,-5.01,;-5.33,-.38,;-4,.39,)|

BDBM364410

Clc1cnc(Nc2ccc(cc2)N2CCN(CCCNC(=O)CC3[C@H]4C[C@@H]5C[C@H](C[C@@H]3C5)C4)CC2)nc1NCc1cccc(NC(=O)C=C)c1 |r,wD:30.32,26.33,24.25,28.28,THB:25:26:23.24.32:29,27:26:23:32.28.29,(-8,-.38,;-6.67,.39,;-5.33,-.38,;-4,.39,;-4,1.93,;-2.67,2.7,;-1.33,1.93,;-1.33,.39,;,-.38,;1.33,.39,;1.33,1.93,;,2.7,;2.67,-.38,;2.67,-1.92,;4,-2.69,;5.33,-1.92,;6.67,-2.69,;8,-1.92,;9.34,-2.69,;10.67,-1.92,;12,-2.69,;12,-4.23,;13.34,-1.92,;14.67,-2.69,;16,-1.92,;17.34,-2.69,;17.34,-4.23,;18.67,-3.46,;18.67,-1.92,;16.4,-3.74,;14.67,-4.23,;16,-5.01,;17.34,-1.15,;5.33,-.38,;4,.39,;-5.33,2.7,;-6.67,1.93,;-8,2.7,;-9.34,1.93,;-10.67,2.7,;-10.67,4.24,;-12,5.01,;-13.34,4.24,;-13.34,2.7,;-14.67,1.93,;-16,2.7,;-16,4.24,;-17.34,1.93,;-18.67,2.7,;-12,1.93,)|

BDBM364417

Clc1cnc(Nc2ccc(cc2)N2CCN(CCCCNC(=O)CC3[C@H]4C[C@@H]5C[C@@H](C[C@H]3C5)C4)CC2)nc1NCc1cccc(NC(=O)C=C)c1 |r,wU:25.36,29.35,31.31,27.28,THB:30:29:26:24.31.32,28:29:24:27.26.32,(-8.67,-1.15,;-7.34,-.38,;-6,-1.15,;-4.67,-.38,;-4.67,1.15,;-3.33,1.93,;-2,1.15,;-2,-.38,;-.67,-1.15,;.67,-.38,;.67,1.15,;-.67,1.93,;2,-1.15,;2,-2.69,;3.33,-3.47,;4.67,-2.69,;6,-3.47,;7.34,-2.7,;8.67,-3.47,;10,-2.7,;11.34,-3.47,;12.67,-2.7,;12.67,-1.16,;14,-3.47,;15.34,-2.7,;16.67,-3.47,;18,-4.23,;19.34,-3.47,;19.34,-1.93,;18,-1.16,;16.67,-.39,;15.34,-1.16,;17.56,-1.83,;18,-2.7,;4.67,-1.15,;3.33,-.38,;-6,1.93,;-7.34,1.15,;-8.67,1.93,;-10,1.15,;-11.34,1.93,;-11.34,3.47,;-12.67,4.23,;-14,3.47,;-14,1.93,;-15.34,1.15,;-16.67,1.93,;-16.67,3.47,;-18,1.15,;-19.34,1.93,;-12.67,1.15,)|

BDBM364418

Clc1cnc(Nc2cnn(CCN3CCN(CC3)C(=O)CC3C4C[C@@H]5CC(C4)C[C@H]3C5)c2)nc1NCc1cccc(NC(=O)C=C)c1 |r,wU:29.30,24.25,TLB:27:26:21.22.23:30,THB:25:26:21:23.24.30,(5.44,-3.59,;4.67,-2.25,;3.13,-2.25,;2.36,-.92,;3.13,.41,;2.36,1.75,;.82,1.75,;-.09,2.99,;-1.55,2.52,;-1.55,.98,;-2.88,.21,;-4.22,.98,;-5.55,.21,;-5.55,-1.33,;-6.88,-2.1,;-8.22,-1.33,;-8.22,.21,;-6.88,.98,;-9.55,-2.1,;-9.55,-3.64,;-10.89,-1.33,;-12.22,-2.1,;-13.55,-1.33,;-14.89,-.56,;-16.22,-1.33,;-16.22,-2.87,;-14.89,-3.64,;-14.89,-2.1,;-13.55,-4.41,;-12.22,-3.64,;-13.95,-3.15,;-.09,.5,;4.67,.41,;5.44,-.92,;6.98,-.92,;7.75,.41,;9.29,.41,;10.06,-.92,;11.6,-.92,;12.37,.41,;11.6,1.75,;12.37,3.08,;13.91,3.08,;14.68,1.75,;14.68,4.41,;16.22,4.41,;10.06,1.75,)|

BDBM364420

Clc1cnc(Nc2cnn(c2)C2CCN(CC2)C(=O)CC2[C@H]3CC4C[C@@H](C[C@H]2C4)C3)nc1NCc1cccc(NC(=O)C=C)c1 |r,wD:27.30,21.23,25.26,THB:22:23:20.21.29:26,24:23:20:29.25.26,(4.11,-3.59,;3.34,-2.25,;1.8,-2.25,;1.03,-.92,;1.8,.41,;1.03,1.75,;-.51,1.75,;-1.42,2.99,;-2.88,2.52,;-2.88,.98,;-1.42,.5,;-4.22,.21,;-4.22,-1.33,;-5.55,-2.1,;-6.88,-1.33,;-6.88,.21,;-5.55,.98,;-8.22,-2.1,;-8.22,-3.64,;-9.55,-1.33,;-10.89,-2.1,;-12.22,-1.33,;-13.55,-2.1,;-13.55,-3.64,;-14.89,-2.87,;-14.89,-1.33,;-12.61,-3.15,;-10.89,-3.64,;-12.22,-4.41,;-13.55,-.56,;3.34,.41,;4.11,-.92,;5.65,-.92,;6.42,.41,;7.96,.41,;8.73,-.92,;10.27,-.92,;11.04,.41,;10.27,1.75,;11.04,3.08,;12.58,3.08,;13.35,1.75,;13.35,4.41,;14.89,4.41,;8.73,1.75,)|

BDBM364422

Clc1cnc(Nc2cnn(c2)C2CCN(CCNC(=O)CC3[C@H]4C[C@@H]5C[C@H](C[C@@H]3C5)C4)CC2)nc1NCc1cccc(NC(=O)C=C)c1 |r,wU:22.33,26.32,28.28,24.25,THB:23:24:27:22.30.21,21:28:25:22.30.23,(-6.11,4,;-5.34,2.67,;-3.8,2.67,;-3.03,1.33,;-3.8,,;-3.03,-1.33,;-1.49,-1.33,;-.58,-2.58,;.88,-2.1,;.88,-.56,;-.58,-.09,;2.22,.21,;3.55,-.56,;4.88,.21,;4.88,1.75,;6.22,2.52,;7.55,1.75,;8.88,2.52,;10.22,1.75,;10.22,.21,;11.55,2.52,;12.89,1.75,;12.89,.21,;14.61,.7,;16.89,2.52,;16.89,.98,;15.55,.21,;15.55,1.75,;14.22,2.52,;15.55,3.29,;14.22,-.56,;3.55,2.52,;2.22,1.75,;-5.34,,;-6.11,1.33,;-7.65,1.33,;-8.42,,;-9.96,,;-10.73,1.33,;-12.27,1.33,;-13.04,,;-12.27,-1.33,;-13.04,-2.67,;-14.58,-2.67,;-15.35,-1.33,;-15.35,-4,;-16.89,-4,;-10.73,-1.33,)|

BDBM374981

Cc1ncc(F)cc1[C@H]1CCCN1c1ccn2ncc(C(=O)NC3(C)CC3)c2n1 |r|

BDBM387815

Cc1nc2cnc3[nH]ccc3c2n1[C@H]1CC[C@H](CC#N)CC1 |r,wU:16.19,wD:13.15,(-2.79,.37,;-2.02,-.96,;-2.65,-2.37,;-1.5,-3.4,;-1.5,-4.94,;-.17,-5.71,;1.16,-4.94,;2.63,-5.41,;3.53,-4.17,;2.63,-2.92,;1.16,-3.4,;-.17,-2.63,;-.49,-1.12,;.54,.02,;2.05,-.3,;3.08,.85,;2.6,2.31,;3.63,3.46,;5.14,3.14,;6.64,2.82,;1.09,2.63,;.06,1.49,)|

BDBM387816

OCc1nc2cnc3[nH]ccc3c2n1[C@H]1CC[C@H](CC#N)CC1 |r,wU:17.20,wD:14.16,(-4.33,.37,;-2.79,.37,;-2.02,-.96,;-2.65,-2.37,;-1.5,-3.4,;-1.5,-4.94,;-.17,-5.71,;1.16,-4.94,;2.63,-5.41,;3.53,-4.17,;2.63,-2.92,;1.16,-3.4,;-.17,-2.63,;-.49,-1.12,;.54,.02,;2.05,-.3,;3.08,.85,;2.6,2.31,;3.63,3.46,;5.14,3.14,;6.64,2.82,;1.09,2.63,;.06,1.49,)|

BDBM387817

C[C@@H](O)Cc1nc2cnc3[nH]ccc3c2n1[C@H]1CC[C@H](CC#N)CC1 |r,wU:19.22,1.1,wD:16.18,(-5.1,-.96,;-4.33,.37,;-5.1,1.71,;-2.79,.37,;-2.02,-.96,;-2.65,-2.37,;-1.5,-3.4,;-1.5,-4.94,;-.17,-5.71,;1.16,-4.94,;2.63,-5.41,;3.53,-4.17,;2.63,-2.92,;1.16,-3.4,;-.17,-2.63,;-.49,-1.12,;.54,.02,;2.05,-.3,;3.08,.85,;2.6,2.31,;3.63,3.46,;5.14,3.14,;6.64,2.82,;1.09,2.63,;.06,1.49,)|

BDBM387818

CC(C)(O)CNC(=O)Cc1nc2cnc3[nH]ccc3c2n1[C@H]1CC[C@H](CC#N)CC1 |r,wU:24.27,wD:21.23,(-4.33,5.71,;-5.1,4.37,;-6.64,4.37,;-5.87,5.71,;-4.33,3.04,;-5.1,1.71,;-4.33,.37,;-5.1,-.96,;-2.79,.37,;-2.02,-.96,;-2.65,-2.37,;-1.5,-3.4,;-1.5,-4.94,;-.17,-5.71,;1.16,-4.94,;2.63,-5.41,;3.53,-4.17,;2.63,-2.92,;1.16,-3.4,;-.17,-2.63,;-.49,-1.12,;.54,.02,;2.05,-.3,;3.08,.85,;2.6,2.31,;3.63,3.46,;5.14,3.14,;6.64,2.82,;1.09,2.63,;.06,1.49,)|

BDBM387819

N#CC[C@H]1CCC(CC1)n1c(nc2cnc3[nH]ccc3c12)-c1c[nH]cn1 |r,wU:3.2,(5.45,3.94,;3.94,4.26,;2.44,4.58,;1.41,3.44,;1.88,1.97,;.85,.83,;-.65,1.15,;-1.13,2.61,;-.1,3.76,;-1.68,0,;-3.22,.17,;-3.84,-1.24,;-2.7,-2.27,;-2.7,-3.81,;-1.36,-4.58,;-.03,-3.81,;1.43,-4.29,;2.34,-3.04,;1.43,-1.8,;-.03,-2.27,;-1.36,-1.5,;-3.99,1.5,;-5.45,1.97,;-5.45,3.51,;-3.99,3.99,;-3.08,2.74,)|

BDBM387820

O=C(Cc1nc2cnc3[nH]ccc3c2n1[C@H]1CC[C@H](CC#N)CC1)NCC1CC1 |r,wU:18.21,wD:15.17,(-5.21,-1.06,;-4.44,.27,;-2.9,.27,;-2.13,-1.06,;-2.75,-2.47,;-1.61,-3.5,;-1.61,-5.04,;-.27,-5.81,;1.06,-5.04,;2.52,-5.52,;3.43,-4.27,;2.52,-3.03,;1.06,-3.5,;-.27,-2.73,;-.59,-1.22,;.44,-.08,;1.94,-.4,;2.97,.74,;2.5,2.21,;3.53,3.35,;5.03,3.03,;6.54,2.72,;.99,2.53,;-.04,1.38,;-5.21,1.6,;-4.44,2.94,;-5.21,4.27,;-5.21,5.81,;-6.54,5.04,)|

BDBM387821

O=C(Cc1nc2cnc3[nH]ccc3c2n1[C@H]1CC[C@H](CC#N)CC1)NCCC#N |r,wU:18.21,wD:15.17,(-3.18,.17,;-2.41,1.5,;-.87,1.5,;-.1,.17,;-.72,-1.24,;.42,-2.27,;.42,-3.81,;1.75,-4.58,;3.09,-3.81,;4.55,-4.29,;5.46,-3.04,;4.55,-1.8,;3.09,-2.27,;1.75,-1.5,;1.43,0,;2.46,1.15,;3.97,.83,;5,1.97,;4.52,3.44,;5.56,4.58,;7.06,4.26,;8.57,3.94,;3.02,3.76,;1.99,2.61,;-3.18,2.83,;-4.72,2.83,;-5.49,4.17,;-7.03,4.17,;-8.57,4.17,)|

BDBM387822

O=C(Cc1nc2cnc3[nH]ccc3c2n1[C@H]1CC[C@H](CC#N)CC1)NC1CCOCC1 |r,wU:18.21,wD:15.17,(-3.56,.17,;-2.79,1.5,;-1.25,1.5,;-.48,.17,;-1.11,-1.24,;.04,-2.27,;.04,-3.81,;1.37,-4.58,;2.7,-3.81,;4.17,-4.29,;5.07,-3.04,;4.17,-1.8,;2.7,-2.27,;1.37,-1.5,;1.05,0,;2.08,1.15,;3.59,.83,;4.62,1.97,;4.14,3.44,;5.17,4.58,;6.68,4.26,;8.18,3.94,;2.63,3.76,;1.6,2.61,;-3.56,2.83,;-5.1,2.83,;-5.87,4.17,;-7.41,4.17,;-8.18,2.83,;-7.41,1.5,;-5.87,1.5,)|

BDBM387823

O=C(Cc1nc2cnc3[nH]ccc3c2n1[C@H]1CC[C@H](CC#N)CC1)NCC1CCOCC1 |r,wU:18.21,wD:15.17,(-3.56,-.96,;-2.79,.37,;-1.25,.37,;-.48,-.96,;-1.11,-2.37,;.04,-3.4,;.04,-4.94,;1.37,-5.71,;2.7,-4.94,;4.17,-5.41,;5.07,-4.17,;4.17,-2.92,;2.7,-3.4,;1.37,-2.63,;1.05,-1.12,;2.08,.02,;3.59,-.3,;4.62,.85,;4.14,2.31,;5.17,3.46,;6.68,3.14,;8.18,2.82,;2.63,2.63,;1.6,1.49,;-3.56,1.71,;-5.1,1.71,;-5.87,3.04,;-5.1,4.37,;-5.87,5.71,;-7.41,5.71,;-8.18,4.37,;-7.41,3.04,)|

BDBM387824

CC(C)(CNC(=O)Cc1nc2cnc3[nH]ccc3c2n1[C@H]1CC[C@H](CC#N)CC1)C#N |r,wU:23.26,wD:20.22,(-5.09,-2.66,;-5.49,-1.17,;-4,-1.57,;-4.72,.17,;-3.18,.17,;-2.41,1.5,;-3.18,2.83,;-.87,1.5,;-.1,.17,;-.72,-1.24,;.42,-2.27,;.42,-3.81,;1.75,-4.58,;3.09,-3.81,;4.55,-4.29,;5.46,-3.04,;4.55,-1.8,;3.09,-2.27,;1.75,-1.5,;1.43,0,;2.46,1.15,;3.97,.83,;5,1.97,;4.52,3.44,;5.56,4.58,;7.06,4.26,;8.57,3.94,;3.02,3.76,;1.99,2.61,;-7.03,-1.17,;-8.57,-1.17,)|

BDBM387825

OC1(CNC(=O)Cc2nc3cnc4[nH]ccc4c3n2[C@H]2CC[C@H](CC#N)CC2)CCC1 |r,wU:22.25,wD:19.21,(-7.69,-.4,;-6.36,-1.17,;-5.59,.17,;-4.05,.17,;-3.28,1.5,;-4.05,2.83,;-1.74,1.5,;-.97,.17,;-1.6,-1.24,;-.45,-2.27,;-.45,-3.81,;.88,-4.58,;2.21,-3.81,;3.68,-4.29,;4.58,-3.04,;3.68,-1.8,;2.21,-2.27,;.88,-1.5,;.56,0,;1.59,1.15,;3.1,.83,;4.13,1.97,;3.65,3.44,;4.68,4.58,;6.19,4.26,;7.69,3.94,;2.15,3.76,;1.11,2.61,;-4.87,-1.57,;-5.27,-3.05,;-6.76,-2.66,)|

BDBM387826

Cn1cc(NC(=O)Cc2nc3cnc4[nH]ccc4c3n2[C@H]2CC[C@H](CC#N)CC2)cn1 |r,wU:23.26,wD:20.22,(-8.49,1.71,;-7.16,.94,;-5.7,1.41,;-4.79,.17,;-3.25,.17,;-2.48,1.5,;-3.25,2.83,;-.94,1.5,;-.17,.17,;-.8,-1.24,;.35,-2.27,;.35,-3.81,;1.68,-4.58,;3.01,-3.81,;4.48,-4.29,;5.38,-3.04,;4.48,-1.8,;3.01,-2.27,;1.68,-1.5,;1.36,0,;2.39,1.15,;3.9,.83,;4.93,1.97,;4.45,3.44,;5.48,4.58,;6.99,4.26,;8.49,3.94,;2.95,3.76,;1.91,2.61,;-5.7,-1.08,;-7.16,-.6,)|

BDBM387827

O=C(Cc1nc2cnc3[nH]ccc3c2n1[C@H]1CC[C@H](CC#N)CC1)NC12CCC(CC#N)(CC1)C2 |r,wU:18.21,wD:15.17,(-5.87,-1.63,;-5.1,-.29,;-3.56,-.29,;-2.79,-1.63,;-3.42,-3.03,;-2.27,-4.06,;-2.27,-5.6,;-.94,-6.37,;.39,-5.6,;1.86,-6.08,;2.76,-4.83,;1.86,-3.59,;.39,-4.06,;-.94,-3.29,;-1.26,-1.79,;-.23,-.64,;1.28,-.96,;2.31,.18,;1.83,1.64,;2.86,2.79,;4.37,2.47,;5.87,2.15,;.32,1.97,;-.71,.82,;-5.87,1.04,;-5.1,2.37,;-3.56,2.37,;-2.79,3.71,;-3.56,5.04,;-2.79,6.37,;-1.25,6.37,;.29,6.37,;-5.1,5.04,;-5.87,3.71,;-4.7,3.86,)|

BDBM387828

O=C(Cc1nc2cnc3[nH]ccc3c2n1[C@H]1CC[C@H](CC#N)CC1)Nc1cc[nH]n1 |r,wU:18.21,wD:15.17,(-3.92,.17,;-3.15,1.5,;-1.61,1.5,;-.84,.17,;-1.46,-1.24,;-.32,-2.27,;-.32,-3.81,;1.01,-4.58,;2.35,-3.81,;3.81,-4.29,;4.72,-3.04,;3.81,-1.8,;2.35,-2.27,;1.01,-1.5,;.69,0,;1.72,1.15,;3.23,.83,;4.26,1.97,;3.78,3.44,;4.82,4.58,;6.32,4.26,;7.83,3.94,;2.28,3.76,;1.25,2.61,;-3.92,2.83,;-5.46,2.83,;-6.36,4.08,;-7.83,3.6,;-7.83,2.06,;-6.36,1.59,)|

BDBM387829

OC1(CNC(=O)Cc2nc3cnc4[nH]ccc4c3n2[C@H]2CC[C@H](CC#N)CC2)CC1 |r,wU:22.25,wD:19.21,(-7.77,-.77,;-6.28,-1.17,;-5.51,.17,;-3.97,.17,;-3.2,1.5,;-3.97,2.83,;-1.66,1.5,;-.89,.17,;-1.52,-1.24,;-.38,-2.27,;-.38,-3.81,;.96,-4.58,;2.29,-3.81,;3.76,-4.29,;4.66,-3.04,;3.76,-1.8,;2.29,-2.27,;.96,-1.5,;.64,0,;1.67,1.15,;3.17,.83,;4.2,1.97,;3.73,3.44,;4.76,4.58,;6.27,4.26,;7.77,3.94,;2.22,3.76,;1.19,2.61,;-6.28,-2.71,;-4.95,-1.94,)|

BDBM402040

CN(C(=O)C=C)c1cc(Nc2ncc(Cl)c(NCCCNC(=O)c3ccc(cc3)C#N)n2)ccc1F

BDBM402041

CN(C(=O)C=C)c1cc(Nc2ncc(Cl)c(NCCCNC(=O)c3ccc(cc3)C(F)(F)F)n2)ccc1F

BDBM406663

Fc1cccc(F)c1-c1cc(Nc2ccc(cc2)C(=O)N2CCCC2)c2C(=O)NCc2n1

BDBM406676

Fc1cccc(F)c1-c1cc(Nc2ccc(cc2)C(=O)N2CCC2)c2C(=O)NCc2n1

BDBM406678

Fc1cccc(C#N)c1-c1cc(Nc2ccc(cc2)C(=O)N2CCCC2)c2C(=O)NCc2n1

BDBM406679

Fc1cccc(F)c1-c1cc(Nc2ccc(cc2)C(=O)N2C[C@@H]3COC[C@@H]3C2)c2C(=O)NCc2n1 |r|

BDBM411420

FC(F)(F)[C@@H](CC#N)NCC1CCC(CC1)[C@H]1C2C(C=Nc3[nH]ccc23)C(=O)NC1=O |r,wU:16.16,4.7,c:20,(5.25,7.57,;6.58,6.8,;7.92,7.57,;7.92,6.03,;6.58,5.26,;7.92,4.49,;7.92,2.95,;6.58,2.18,;5.25,4.49,;4,5.39,;2.67,4.62,;2.67,3.08,;1.33,2.31,;0,3.08,;0,4.62,;1.33,5.39,;-1.33,2.31,;-1.33,.77,;-2.67,0,;-2.67,-1.54,;-1.33,-2.31,;0,-1.54,;1.46,-2.02,;2.37,-.77,;1.47,.48,;0,0,;-4,.77,;-5.33,0,;-4,2.31,;-2.67,3.08,;-2.67,4.62,)|

BDBM411421

FC(F)(F)CCOCC1CCC(CC1)[C@H]1C2C(C=Nc3[nH]ccc23)C(=O)NC1=O |r,wU:14.14,c:18,(6.58,2.18,;7.92,2.95,;9.25,2.18,;7.92,1.41,;7.92,4.49,;6.58,5.26,;5.25,4.49,;4,5.39,;2.67,4.62,;2.67,3.08,;1.33,2.31,;0,3.08,;0,4.62,;1.33,5.39,;-1.33,2.31,;-1.33,.77,;-2.67,0,;-2.67,-1.54,;-1.33,-2.31,;0,-1.54,;1.46,-2.02,;2.37,-.77,;1.47,.48,;0,0,;-4,.77,;-5.33,0,;-4,2.31,;-2.67,3.08,;-2.67,4.62,)|

BDBM411422

FC(F)(F)[C@@H](CC#N)NCC1CCC(CC1)N1C=CC(=O)C2C=Nc3[nH]ccc3C12 |r,wU:4.7,c:18,23,(5.25,7.57,;6.58,6.8,;7.92,7.57,;7.92,6.03,;6.58,5.26,;7.92,4.49,;7.92,2.95,;6.58,2.18,;5.25,4.49,;4,5.39,;2.67,4.62,;2.67,3.08,;1.33,2.31,;0,3.08,;0,4.62,;1.33,5.39,;-1.33,2.31,;-2.67,3.08,;-4,2.31,;-4,.77,;-5.33,0,;-2.67,0,;-2.67,-1.54,;-1.33,-2.31,;0,-1.54,;1.46,-2.02,;2.37,-.77,;1.47,.48,;0,0,;-1.33,.77,)|

BDBM411423

Cc1cnn(CC2CCC(CC2)N2C=CC(=O)C3C=Nc4[nH]ccc4C23)c1 |c:14,19,(9.12,3.4,;7.62,3.72,;6.71,2.47,;5.25,2.95,;5.25,4.49,;4,5.39,;2.67,4.62,;2.67,3.08,;1.33,2.31,;0,3.08,;0,4.62,;1.33,5.39,;-1.33,2.31,;-2.67,3.08,;-4,2.31,;-4,.77,;-5.33,0,;-2.67,0,;-2.67,-1.54,;-1.33,-2.31,;0,-1.54,;1.46,-2.02,;2.37,-.77,;1.47,.48,;0,0,;-1.33,.77,;6.71,4.96,)|

BDBM411424

FC(F)(F)COCC1CCC(CC1)N1C=CC(=O)C2C=Nc3[nH]ccc3C12 |c:15,20,(5.89,7.5,;7.03,6.47,;8.5,6.94,;8.18,5.44,;6.71,4.96,;5.25,4.49,;4,5.39,;2.67,4.62,;2.67,3.08,;1.33,2.31,;0,3.08,;0,4.62,;1.33,5.39,;-1.33,2.31,;-2.67,3.08,;-4,2.31,;-4,.77,;-5.33,0,;-2.67,0,;-2.67,-1.54,;-1.33,-2.31,;0,-1.54,;1.46,-2.02,;2.37,-.77,;1.47,.48,;0,0,;-1.33,.77,)|

BDBM411425

FC(F)(F)CCOCC1CCC(CC1)N1C=CC(=O)C2C=Nc3[nH]ccc3C12 |c:16,21,(8.82,8.45,;8.5,6.94,;9.64,5.91,;8.18,5.44,;7.03,6.47,;6.71,4.96,;5.25,4.49,;4,5.39,;2.67,4.62,;2.67,3.08,;1.33,2.31,;0,3.08,;0,4.62,;1.33,5.39,;-1.33,2.31,;-2.67,3.08,;-4,2.31,;-4,.77,;-5.33,0,;-2.67,0,;-2.67,-1.54,;-1.33,-2.31,;0,-1.54,;1.46,-2.02,;2.37,-.77,;1.47,.48,;0,0,;-1.33,.77,)|

BDBM411426

FC(F)(F)[C@H](CC#N)OCC1CCC(CC1)N1C=CC(=O)C2C=Nc3[nH]ccc3C12 |r,wU:4.7,c:18,23,(7.54,2.43,;7.86,3.93,;9.32,4.41,;9,2.9,;6.71,4.96,;7.03,6.47,;8.5,6.94,;8.82,8.45,;5.25,4.49,;4,5.39,;2.67,4.62,;2.67,3.08,;1.33,2.31,;0,3.08,;0,4.62,;1.33,5.39,;-1.33,2.31,;-2.67,3.08,;-4,2.31,;-4,.77,;-5.33,0,;-2.67,0,;-2.67,-1.54,;-1.33,-2.31,;0,-1.54,;1.46,-2.02,;2.37,-.77,;1.47,.48,;0,0,;-1.33,.77,)|

BDBM412667

COc1cc2c3cnc4[nH]ccc4c3n(CCCN(C)C)c(=O)c2cc1OC

BDBM412668

CN(C)CCCn1c2c3cc[nH]c3ncc2c2ccccc2c1=O

BDBM412669

CN(C)CCCn1c2c3cc[nH]c3ncc2c2ccc(cc2c1=O)[N+]([O-])=O

BDBM412671

COc1cc2c3cnc4[nH]ccc4c3n(CC(=O)OC(C)(C)C)c(=O)c2cc1OC

BDBM412672

COC(=O)Cn1c2c3cc[nH]c3ncc2c2cc(OC)c(OC)cc2c1=O

BDBM412673

CCOC(=O)C(CC)n1c2c3cc[nH]c3ncc2c2cc(OC)c(OC)cc2c1=O |w:8.7|

BDBM412674

COc1cc2c3cnc4[nH]ccc4c3n(C3CCCCC3)c(=O)c2cc1OC

BDBM412675

COc1cc2c3cnc4[nH]ccc4c3n(CC3CCCCC3)c(=O)c2cc1OC

BDBM412676

COc1cc2c3cnc4[nH]ccc4c3n(C3CCCCCC3)c(=O)c2cc1OC

BDBM412680

COc1cc2c3cnc4[nH]ccc4c3n(C3CCCCCCC3)c(=O)c2cc1OC

BDBM412681

COc1cc2c3cnc4[nH]ccc4c3n(C3CCN(C)CC3)c(=O)c2cc1OC

BDBM412682

COc1cc2c3cnc4[nH]ccc4c3n(C3CCNCC3)c(=O)c2cc1OC

BDBM412683

COc1cc2c3cnc4[nH]ccc4c3n([C@@H]3CCNC3)c(=O)c2cc1OC |r|

BDBM412684

COc1cc2c3cnc4[nH]ccc4c3n(C3CCCNC3)c(=O)c2cc1OC

BDBM412685

COC(=O)[C@@H](C(C)C)n1c2c3cc[nH]c3ncc2c2cc(OC)c(OC)cc2c1=O |r|

BDBM412686

COC(=O)[C@H](C(C)C)n1c2c3cc[nH]c3ncc2c2cc(OC)c(OC)cc2c1=O |r|

BDBM412687

COc1cc2c3cnc4[nH]ccc4c3n([C@@H]3CCCN(C3)C(=O)CC#N)c(=O)c2cc1OC |r|

BDBM412688

COc1cc2c3cnc4[nH]ccc4c3n([C@H](C(C)C)C(=O)N3CC(C3)C#N)c(=O)c2cc1OC |r|

BDBM412689

COc1cc2c3cnc4[nH]ccc4c3n([C@H](C(C)C)C(=O)NCC(F)(F)F)c(=O)c2cc1OC |r|

BDBM412690

CC[C@H](C(=O)N1CC(C1)C#N)n1c2c3cc[nH]c3ncc2c2cc(OC)c(OC)cc2c1=O |r|

BDBM412691

CC[C@H](C(=O)NCC(F)(F)F)n1c2c3cc[nH]c3ncc2c2cc(OC)c(OC)cc2c1=O |r|

BDBM412692

COc1cc2c3cnc4[nH]ccc4c3n(C(C(C)C)C(=O)NCC(F)(F)F)c(=O)c2cc1OC

BDBM419594

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2C[C@@H]2C#N)cn1 |r,THB:19:18:17.11.12:15.14|

BDBM419595

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H]2C[C@H]2C#N)cn1 |r,THB:19:18:17.11.12:15.14|

BDBM419628

N#CC1(CN2[C@H]3CC[C@@H]2CN(C3)c2ccnc(Nc3cn[nH]c3)n2)CC1 |r,THB:12:10:4:7.6|

BDBM419635

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3c2ncc(o2)C#N)cn1 |r,THB:19:18:17.11.12:15.14|

BDBM419640

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C2(CC#N)CN(C2)S(C)(=O)=O)cn1 |r,TLB:9:11:18:15.14|

BDBM419641

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3C2(CC#N)COC2)cn1 |r,THB:19:18:17.11.12:15.14|

BDBM419649

Cn1cc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3c2cc(ccn2)C#N)cn1 |r,THB:19:18:17.11.12:15.14|

BDBM419652

C[C@@H]1[C@@H]2CN(C[C@]12NC(=O)[C@@H]1C[C@H]1C#N)c1nc(Nc2cnn(C)c2)ncc1F |r|

BDBM419655

C[C@@H]1[C@@H]2CN(C[C@]12NC(=O)[C@H]1C[C@@H]1C#N)c1nc(Nc2ccc(OCCO)nc2)ncc1C |r|

BDBM419667

Cn1cc(Nc2ncc(F)c(n2)N2C[C@@]3(CO)C[C@]3(C2)NC(=O)[C@@H]2C[C@H]2C#N)cn1 |r|

BDBM420035

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2C(=O)C(F)F |r,TLB:27:26:23.22.21:18.25.19|

BDBM420063

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2CC1CC1C#N |r,TLB:27:26:23.22.21:18.25.19|

BDBM420068

CCC(C)OC(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)N(C)c1nc(Nc2cc(CO)[nH]n2)cc(OC)n1 |r,TLB:5:7:11.10.9:14.13.15|

BDBM420071

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2C(=O)C1CC1 |r,TLB:27:26:23.22.21:18.25.19|

BDBM420072

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2C |r,TLB:27:26:23.22.21:18.25.19|

BDBM420073

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2C1CCCC1 |r,TLB:27:26:23.22.21:18.25.19|

BDBM420074

COc1cc(Nc2cc(CO)[nH]n2)nc(n1)N(C)[C@H]1C[C@@H]2CCC[C@H](C1)N2C1CCC1 |r,TLB:27:26:23.22.21:18.25.19|

BDBM425494

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CC(N(C)Cc2[nH]1)C(=O)N1CCN(CC1)C(C)C

BDBM425851

CCN1Cc2[nH]c(nc2C[C@H]1C(=O)N1CCN(CC1)C(C)(C)C)-c1n[nH]c2cc(ccc12)-c1cc(F)c(O)cc1CC |r|

BDBM425122

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2C[C@@H](CN3CC[C@@H](C3)N(C)C)N(Cc2[nH]1)C(C)C |r|

BDBM767721

Cn5cc(c4cn1nccc1c(c3cn(C2(CC#N)CN(CC#N)C2)nc3N)n4)cn5

BDBM767722

CCS(=O)(=O)N1CC(CC#N)(n2cc(-c3nc(-c4cnn(C)c4)cn4nccc34)c(N)n2)C1

BDBM767723

CC(C)S(=O)(=O)N1CC(CC#N)(n2cc(-c3nc(-c4cnn(C)c4)cn4nccc34)c(N)n2)C1

BDBM767724

CC(C)S(=O)(=O)N1CC(CC#N)(n2cc(-c3nc(-c4cnn(C)c4)cn4ncc(C#N)c34)c(N)n2)C1

BDBM767725

Cn1cc(-c2cn3nccc3c(-c3cn([C@]4(CC#N)C[C@H](C#N)C4)nc3N)n2)cn1

BDBM767726

Cn5cc(c4cn1nccc1c(c3cn([C@]2(CC#N)C[C@@H](C#N)C2)nc3N)n4)cn5

BDBM767727

CNc1nn([C@]2(CC#N)C[C@@H](C#N)C2)cc1-c1nc(-c2cnn(C)c2)cn2nccc12

BDBM767728

CN(C)c1nn([C@]2(CC#N)C[C@@H](C#N)C2)cc1-c1nc(-c2cnn(C)c2)cn2nccc12

BDBM767729

CC(=O)Nc1nn([C@]2(CC#N)C[C@@H](C#N)C2)cc1-c1nc(-c2cnn(C)c2)cn2nccc12

BDBM767730

Cn1cc(-c2cn3ncnc3c(-c3cn([C@]4(CC#N)C[C@@H](C#N)C4)nc3N)n2)cn1

BDBM767731

Cn1cc(-c2cc(-c3cn([C@]4(CC#N)C[C@@H](C#N)C4)nc3N)c3ccnn3c2)cn1

BDBM767732

Cn1cc(-c2cc(-c3cn([C@]4(CC#N)C[C@H](C#N)C4)nc3N)c3ccnn3c2)cn1

BDBM767733

Cn1cc(-c2cn3nccc3c(-c3cn([C@]4(CC#N)C[C@H](C#N)C4)c4ccncc34)n2)cn1

BDBM767734

Cn1cc(-c2cn3nccc3c(-c3cn([C@]4(CC#N)C[C@@H](C#N)C4)c4ccncc34)n2)cn1

BDBM767735

Cn1cc(-c2cn3nccc3c(-c3cn([C@]4(CC#N)C[C@H](C#N)C4)c4ncncc34)n2)cn1

BDBM767736

Cn1cc(-c2cn3nccc3c(-c3cn([C@]4(CC#N)C[C@H](C#N)C4)c4ncncc34)n2)cn1

BDBM50239229

C(Nc1nc(nc2cccc(-c3ccccc3)c12)-c1cncnc1)c1ccccn1

BDBM455296

O=C(Nc1cn2c(cccc2n1)-c1ccc(CN2CCS(=O)(=O)CC2)cc1)C1CC1

BDBM455298

O=C(Nc1cn2c(cccc2n1)-c1ccc(CN2CCS(=O)(=O)CC2)cc1)C1CCC1

BDBM455299

O=C(Nc1cn2c(cccc2n1)-c1ccc(CN2CCOCC2)cc1)C1CC1

BDBM455305

CN1CCN(Cc2ccc(cc2)-c2cccc3nc(NC(=O)C4CC4)cn23)CC1

BDBM455306

O=C(Nc1cn2c(cccc2n1)-c1ccc(CN2CCCCC2)cc1)C1CC1

BDBM455307

O=C(Nc1cn2c(cccc2n1)-c1ccc(CN2CCC(CC2)C#N)cc1)C1CC1

BDBM455308

O[C@H]1CCN(Cc2ccc(cc2)-c2cccc3nc(NC(=O)C4CC4)cn23)C1 |r|

BDBM455309

O[C@@H]1CCN(Cc2ccc(cc2)-c2cccc3nc(NC(=O)C4CC4)cn23)C1 |r|

BDBM455310

COc1ccc(cc1)-c1cccc2nc(NC(=O)C3CC3)cn12

BDBM455311

O=C(Nc1cn2c(cccc2n1)-c1ccc(CC#N)cc1)C1CC1

BDBM455312

Cc1cc(CN2CCS(=O)(=O)CC2)ccc1-c1cccc2nc(NC(=O)C3CC3)cn12

BDBM455314

Fc1cc(CN2CCS(=O)(=O)CC2)ccc1-c1cccc2nc(NC(=O)C3CC3)cn12

BDBM455315

Fc1cc(CC#N)ccc1-c1cccc2nc(NC(=O)C3CC3)cn12

BDBM455316

CC1(C)CN(C1)C(=O)c1ccc(cc1)-c1cccc2nc(NC(=O)C3CC3)cn12

BDBM455317

Nc1cn2c(cccc2n1)-c1ccc(CN2CCS(=O)(=O)CC2)cc1

BDBM455318

Nc1cn2c(cccc2n1)-c1ccc(CC#N)cc1

BDBM455319

Nc1cn2c(cccc2n1)-c1ccc(CC#N)cc1F

BDBM455320

O=C(Nc1cn2c(cccc2n1)-c1ccc(cc1)C1(CC1)C#N)C1CC1

BDBM455321

CC1(C)CN(C1)C(=O)c1ccc(c(F)c1)-c1cccc2nc(NC(=O)C3CC3)cn12

BDBM455322

CC1(C)CN(C1)C(=O)c1ccc(cc1F)-c1cccc2nc(NC(=O)C3CC3)cn12

BDBM455323

CC1(C)CN(Cc2ccc(cc2)-c2cccc3nc(NC(=O)C4CC4)cn23)C1

BDBM455324

Fc1cc(ccc1CC#N)-c1cccc2nc(NC(=O)C3CC3)cn12

BDBM455325

CC(C#N)c1ccc(cc1)-c1cccc2nc(NC(=O)C3CC3)cn12

BDBM455326

Fc1cc(ccc1CN1CCS(=O)(=O)CC1)-c1cccc2nc(NC(=O)C3CC3)cn12

BDBM455327

O=C(Nc1cn2c(cccc2n1)-c1cccc(CN2CCS(=O)(=O)CC2)c1)C1CC1

BDBM455328

O=C(Nc1cn2c(cccc2n1)-c1ccc(NS(=O)(=O)C2CC2)cc1)C1CC1

BDBM455329

FC(F)(F)CC(=O)NCc1ccc(cc1)-c1cccc2nc(NC(=O)C3CC3)cn12

BDBM455330

O=C(Nc1cn2c(cccc2n1)-c1ccc(CNc2ccccc2CC#N)cc1)C1CC1

BDBM455331

Cc1cc(-c2ccc(CN3CCS(=O)(=O)CC3)cc2)n2cc(NC(=O)C3CC3)nc2c1

BDBM455332

Clc1ccc2nc(NC(=O)C3CC3)cn2c1-c1ccc(CN2CCS(=O)(=O)CC2)cc1

BDBM455333

Cc1ccc(-c2ccc(CN3CCS(=O)(=O)CC3)cc2)n2cc(NC(=O)C3CC3)nc12

BDBM455361

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC2CCCN2)c1

BDBM455371

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CC(C1)S(C)(=O)=O |(.49,4.45,;-.6,3.36,;-2.09,3.76,;-2.49,5.25,;-1.4,6.34,;-3.18,2.67,;-2.7,1.21,;-3.95,.3,;-5.2,1.21,;-4.72,2.67,;-3.95,-1.24,;-2.62,-2.01,;-2.62,-3.55,;-3.95,-4.32,;-5.28,-3.55,;-6.75,-4.03,;-7.65,-2.78,;-6.75,-1.53,;-5.28,-2.01,;-1.28,-4.32,;-1.28,-5.86,;.18,-6.34,;1.09,-5.09,;.18,-3.84,;2.57,-4.69,;3.91,-5.46,;4.68,-4.13,;3.34,-3.36,;6.17,-3.73,;7.25,-4.82,;6.94,-2.4,;7.65,-3.33,)|

BDBM455427

C[C@H]1CCC[C@H]1n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM455454

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(CC2C[C@H](O)C2)c1 |r,wU:26.29,(-1.21,8.16,;-1.98,6.82,;-1.21,5.49,;.33,5.49,;1.1,6.82,;-1.98,4.16,;-1.51,2.69,;-2.75,1.79,;-4,2.69,;-3.52,4.16,;-2.75,.25,;-1.42,-.52,;-1.42,-2.06,;-2.75,-2.83,;-4.09,-2.06,;-5.55,-2.54,;-6.45,-1.29,;-5.55,-.05,;-4.09,-.52,;-.08,-2.83,;-.08,-4.37,;1.38,-4.85,;2.29,-3.6,;3.83,-3.6,;4.6,-4.94,;4.2,-6.42,;5.68,-6.82,;6.45,-8.16,;6.08,-5.34,;1.38,-2.36,)|

BDBM455493

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@@H]1OCC[C@H]1O |r|

BDBM455494

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@H]1OCC[C@@H]1O |r|

BDBM455523

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C1CCC[C@@H]1O |r|

BDBM455539

CC[C@@H](CC1CC1)n1cc(cn1)-c1cnn2cc(ncc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM455540

CCC(CC1CC1)n1cc(cn1)-c1cnn2cc(ncc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM455543

CCC(CC(F)(F)F)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM455545

CCC(CC(F)(F)F)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)C(CO)CO

BDBM455552

CCC(C1CC1)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@H](C)O)c1 |r|

BDBM50355501

c1c[nH]c2c1c(ncn2)c3cnn(c3)[C@H](CC#N)C4CCCC4

BDBM50021655

CC[C@@](C)(Nc1ccnc(n1)-c1c[nH]c2ncccc12)C(=O)NCC(F)(F)F |r|

BDBM50311017

O=C(NCC#N)c1ccc(cc1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1

BDBM294911

C[C@H](Nc1ncc(Cl)c(Nc2cc(C)[nH]n2)n1)c1ncc(F)cn1 |r|

BDBM147644

NC(=O)c1cn(nc1Nc1ccc(cc1)C(F)(F)F)[C@H]1CC[C@@H](O)C[C@@H]1C#N |r|

BDBM50402074

CS(=O)(=O)NCc1nc2cnc3c(c2n1[C@@H]4C[C@H]5CC[C@@H]4C5)cc[nH]3

BDBM462293

NC(=O)c1cn(nc1Nc1ccc(cc1)C(F)(F)F)[C@H]1CC[C@@H](C[C@@H]1C#N)N1CCC1 |r|

BDBM462294

NC(=O)c1cn(nc1Nc1ccc(cc1)C(F)(F)F)[C@@H]1CC[C@H](C[C@H]1C#N)N1CCC1 |r|

BDBM294916

O=C(Nc1nc2cccc(-c3ccc(OCc4ccc(nc4)C#N)cc3)n2n1)C1CC1

BDBM50021656

CCS(=O)(=O)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12

BDBM463567

Fc1cccc(F)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCOCC1

BDBM463568

CCNC(=O)Cc1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1F

BDBM463569

CCNC(=O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1F

BDBM463570

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCOCC1

BDBM463571

CN1CCN(CC1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1F

BDBM463572

CN1CCN(CC1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463573

CCNC(=O)Cc1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463574

Fc1cccc(F)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCC2(CCOCC2)CC1

BDBM463575

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)C1CCOCC1

BDBM463576

OC1CCN(CC1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463577

CC(C)n1ccc(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463578

Fc1cccc(F)c1-c1cc(c2C(=O)NCc2n1)-n1cccn1

BDBM463579

Fc1cccc(Cl)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCC(CC1)N1CCOCC1

BDBM463580

CC1(C)COC(=N1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |c:5|

BDBM463581

CC(C)n1cc(cn1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463582

CC1(O)CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463583

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(NCCN2CCOCC2)n1

BDBM463584

OCCNc1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463585

OC1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463586

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCC(CC1)N1CCCC1

BDBM463587

CN(C)[C@H]1CC[C@@H](CC1)Nc1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r,wU:3.2,wD:6.9,(-5.32,-3.79,;-6.09,-2.45,;-7.63,-2.45,;-5.32,-1.12,;-6.09,.21,;-5.32,1.55,;-3.78,1.55,;-3.01,.21,;-3.78,-1.12,;-3.01,2.88,;-1.48,3.04,;-.71,4.38,;.8,4.06,;.96,2.52,;-.45,1.9,;2.29,1.75,;2.29,.21,;3.63,-.56,;4.96,.21,;4.96,1.75,;6.11,2.79,;5.48,4.19,;3.95,4.03,;2.92,5.18,;3.63,2.52,;3.63,-2.1,;2.29,-2.87,;.96,-2.1,;2.29,-4.41,;3.63,-5.18,;4.96,-4.41,;5.01,-2.84,;6.34,-2.07,;7.68,-1.3,)|

BDBM463588

NC1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463589

O[C@@H]1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463590

O[C@H]1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463591

C[C@@]1(O)CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463592

C[C@]1(O)CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463593

N[C@@H]1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463594

N[C@H]1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463595

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1cc2CCCNc2n1

BDBM463596

OC1CCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463597

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1cc2NCCCc2n1

BDBM463599

O[C@@H]1CCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463600

O[C@H]1CCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463601

OC1(CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N)C(F)(F)F

BDBM463602

CS(=O)(=O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463603

COCCOC1CN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463604

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCCOCC1

BDBM463605

NC1(CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N)C(F)(F)F

BDBM463606

CC1CC(O)CC(C)N1c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463607

OCC1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463608

CC1(O)CCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463609

O[C@@]1(CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N)C(F)(F)F |r|

BDBM463610

O[C@]1(CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N)C(F)(F)F |r|

BDBM463611

OCC1COCCN1c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1F

BDBM463612

OC(=O)C1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463613

C[C@@]1(O)CCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463614

C[C@]1(O)CCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463615

OCCc1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463616

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCCC(C1)C#N

BDBM463617

CC1CCC(O)CN1c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463618

OC[C@@H]1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463619

OC[C@H]1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463620

CN1CC(C1)S(=O)(=O)N1CCN(CC1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463621

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCC2(C1)OCCO2

BDBM463622

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)C1CCCO1

BDBM463623

OC(=O)Cc1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463624

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)[C@H]1CCCO1 |r|

BDBM463625

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)[C@@H]1CCCO1 |r|

BDBM463626

O[C@@H]1CCN(C[C@@H]1O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463627

C[C@@H]1CC(O)C[C@@H](C)N1c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463628

C[C@H]1CC(O)C[C@@H](C)N1c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463629

CC1(O)CN(CC[C@H]1O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r,w:1.0|

BDBM463630

O[C@H]1CN(C[C@H]1O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463631

CN1CC2(C1)CCN(CC2)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463633

C[C@H]1CC[C@H](O)CN1c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463634

C[C@H]1CC[C@@H](O)CN1c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463636

O[C@H]1CCCN(C[C@H]1O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463637

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCC(C1)C#N

BDBM463638

CN(C)[C@H]1CC[C@@H](CC1)Oc1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r,wU:3.2,wD:6.9,(-7.34,-2.91,;-5.81,-2.75,;-4.9,-3.99,;-5.18,-1.34,;-6.08,-.09,;-5.46,1.31,;-3.93,1.47,;-3.02,.23,;-3.65,-1.18,;-3.3,2.88,;-1.77,3.04,;-1,4.38,;.51,4.06,;.67,2.52,;-.74,1.9,;2,1.75,;2,.21,;3.34,-.56,;4.67,.21,;4.67,1.75,;5.81,2.79,;5.19,4.19,;3.66,4.03,;2.63,5.18,;3.34,2.52,;3.34,-2.1,;2,-2.87,;.67,-2.1,;2,-4.41,;3.34,-5.18,;4.67,-4.41,;4.72,-2.84,;6.05,-2.07,;7.39,-1.3,)|

BDBM463639

N[C@]1(CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N)C(F)(F)F |r|

BDBM463640

N[C@@]1(CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N)C(F)(F)F |r|

BDBM463641

CS(=O)(=O)NC1CCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463642

OC1COCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463643

NC(=O)C1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463644

CC(=O)NC1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463645

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1cc2CNCc2n1

BDBM463646

NC(=O)[C@@H]1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463647

NC(=O)[C@H]1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463648

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CC[C@H](C1)C#N |r|

BDBM463649

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CC[C@@H](C1)C#N |r|

BDBM463650

CC(=O)N[C@@H]1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463651

CC(=O)N[C@H]1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463652

O[C@@H]1COCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463653

O[C@H]1COCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463654

CC1(CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N)C#N

BDBM463655

CS(=O)(=O)N[C@@H]1CCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463656

CS(=O)(=O)N[C@H]1CCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463657

O[C@H]1CCN(C[C@H]1O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463659

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCOCC1=O

BDBM463660

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCCC1=O

BDBM463661

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCCNC(=O)C1

BDBM463662

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCNC(=O)CC1

BDBM463664

CO[C@H]1CN(C[C@H]1O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463666

C[C@@]1(O)CN(C[C@](C)(O)C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463667

C[C@@]1(O)CN(C[C@@](C)(O)C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463668

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCC2(CCNC2=O)C1

BDBM463669

CN1CCN(CC1)C1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463670

O[C@H]1CCN(C1=O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463671

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCCC(C1)N1CCOCC1

BDBM463672

C[C@H]1[C@H](O)CCN1c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463673

CC(C)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463674

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCCC(C1)C(=O)N1CCCC1

BDBM463676

CO[C@@H]1CN(C[C@@H]1O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463677

CN1CCN(CC1)[C@H]1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463678

CN1CCN(CC1)[C@@H]1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463679

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCC[C@@H](C1)N1CCOCC1 |r|

BDBM463680

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCC[C@H](C1)N1CCOCC1 |r|

BDBM463681

CCNC(=O)C1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463682

OC1CN(CCC1F)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463683

CC1O[C@@H]2CN(C[C@@H]2O1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463684

C[C@]1(O)CN(CC[C@H]1O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463685

OC[C@H]1COCCN1c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463687

OC[C@@H]1COCCN1c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463688

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CC[C@]2(CCNC2=O)C1 |r|

BDBM463689

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CC[C@@]2(CCNC2=O)C1 |r|

BDBM463690

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCC[C@H](C1)C(=O)N1CCCC1 |r|

BDBM463691

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCC[C@@H](C1)C(=O)N1CCCC1 |r|

BDBM463692

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1C[C@H]2OCCO[C@H]2C1 |r|

BDBM463694

CCNC(=O)[C@H]1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463695

CCNC(=O)[C@@H]1CCCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463696

O[C@H]1CN(CC[C@H]1F)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463697

O[C@@H]1CN(CC[C@@H]1F)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463698

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCNC(=O)C1

BDBM463699

CO[C@@H]1CCN(C[C@@H]1OC)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463700

CC(=O)Nc1cnn(c1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463702

O[C@@H]1CCCN(C[C@@H]1O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463703

NC(=O)C1CNc2cn(nc2C1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463704

CO[C@H]1CN(CC[C@H]1O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463705

C[C@@]1(O)CN(CC[C@H]1O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463708

OC1CCN(C1)c1nn(cc1F)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463710

CC1(C)C(O)CCN1c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463711

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1C[C@@H]2CC[C@H](C1)O2 |r|

BDBM463712

O[C@@H]1CCN(C1)c1nn(cc1F)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463713

O[C@H]1CCN(C1)c1nn(cc1F)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463714

OC1(CCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N)C(=O)N1CCCC1

BDBM463715

OC1COC2(CCN(C2)c2ccn(n2)-c2cc(nc3CNC(=O)c23)-c2c(F)cccc2C#N)OC1

BDBM463716

CO[C@@H]1CCN(C[C@H]1O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463718

CO[C@@H]1CN(CC[C@H]1O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463720

O[C@]1(CCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N)C(=O)N1CCCC1 |r|

BDBM463721

O[C@@]1(CCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N)C(=O)N1CCCC1 |r|

BDBM463725

CO[C@H]1CN(CC[C@@H]1O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463727

CC1(C)[C@H](O)CCN1c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463728

CC1(C)[C@@H](O)CCN1c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463733

CO[C@H]1CCN(C[C@@H]1O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463735

CC(=O)Nc1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463736

CO[C@@H]1CCN(C[C@]1(C)O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463737

OC[C@@H]1C[C@@H](O)CN1c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463738

O[C@H]1CN(CC[C@@H]1C#N)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463740

O[C@@H]1CN(CC[C@H]1C#N)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463741

O[C@@H]1CCN(C[C@@H]1N1CCOCC1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463742

CC1(O)CN(CCC1F)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |w:1.0|

BDBM463744

O[C@H]1CO[C@@]2(CCN(C2)c2ccn(n2)-c2cc(nc3CNC(=O)c23)-c2c(F)cccc2C#N)OC1 |r,wU:1.0,wD:4.8,(-2.95,8.98,;-3.27,7.47,;-2.12,6.44,;-2.44,4.93,;-3.91,4.46,;-5.31,3.83,;-5.15,2.3,;-3.65,1.98,;-2.88,3.31,;-3.02,.57,;-3.79,-.76,;-2.76,-1.9,;-1.35,-1.28,;-1.51,.25,;-.02,-2.05,;-.02,-3.59,;1.31,-4.36,;2.65,-3.59,;2.65,-2.05,;3.79,-1.02,;3.17,.39,;1.63,.23,;.6,1.37,;1.31,-1.28,;1.31,-5.9,;-.02,-6.67,;-1.35,-5.9,;-.02,-8.21,;1.31,-8.98,;2.65,-8.21,;2.7,-6.64,;4.03,-5.87,;5.36,-5.1,;-5.05,5.49,;-4.73,7,)|

BDBM463745

O[C@H]1CO[C@]2(CCN(C2)c2ccn(n2)-c2cc(nc3CNC(=O)c23)-c2c(F)cccc2C#N)OC1 |r,wD:4.8,1.0,(-2.95,8.98,;-3.27,7.47,;-4.73,7,;-5.05,5.49,;-3.91,4.46,;-5.31,3.83,;-5.15,2.3,;-3.65,1.98,;-2.88,3.31,;-3.02,.57,;-3.79,-.76,;-2.76,-1.9,;-1.35,-1.28,;-1.51,.25,;-.02,-2.05,;-.02,-3.59,;1.31,-4.36,;2.65,-3.59,;2.65,-2.05,;3.79,-1.02,;3.17,.39,;1.63,.23,;.6,1.37,;1.31,-1.28,;1.31,-5.9,;-.02,-6.67,;-1.35,-5.9,;-.02,-8.21,;1.31,-8.98,;2.65,-8.21,;2.7,-6.64,;4.03,-5.87,;5.36,-5.1,;-2.44,4.93,;-2.12,6.44,)|

BDBM463748

CN1CCOC2CN(C[C@H]12)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463749

CO[C@H]1CN(C[C@@]1(C)O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463750

CC1=C(CNC1=O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |t:1|

BDBM463752

CO[C@H]1CCN(C[C@@]1(C)O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463753

CO[C@H]1CN(C[C@@]1(C)OC)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463754

Fc1cccc(C#N)c1-c1cc(-c2ccn(n2)C(=O)N2CCOCC2)c2C(=O)NCc2n1

BDBM463755

CC(C)c1ncn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM463756

CC(C)c1csc(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1F

BDBM463757

O[C@H]1COCC1n1ccc(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM463758

OC1CNc2cc(nn2C1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM466343

O[C@H](CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C1CCCC1 |r|

BDBM466344

OC(CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C1CCCCC1 |r|

BDBM466345

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@@H](O)C1CCCCC1 |r|

BDBM466346

O[C@H](CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C1CCCCC1 |r|

BDBM466347

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@@H](O)C1CCCC1 |r|

BDBM466348

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@@H](O)c1ccc(F)cc1 |r|

BDBM466349

O[C@H](CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(F)cc1 |r|

BDBM466350

O[C@H](CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(cc1)C#N |r|

BDBM466351

OC[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@@H](O)c1ccc(F)cc1 |r|

BDBM466352

O[C@@H](CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C1CCOCC1 |r|

BDBM466353

O[C@@H](CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C1CCCC1 |r|

BDBM466354

O[C@H](CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(F)cn1 |r|

BDBM466355

O=C(NCc1ccc(cc1)C#N)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12 |r|

BDBM466356

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(C#N)c(F)c1 |r|

BDBM466357

O[C@@H](CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C1CCCCC1 |r|

BDBM466358

Fc1cc(CNC(=O)[C@H]2CCN(CC22CC2)c2ncnc3[nH]ccc23)ccc1C#N |r|

BDBM466359

OC[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(F)cc1 |r|

BDBM466360

OC[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(cc1)C#N |r|

BDBM466361

OC[C@H](NC(=O)C1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(cc1)C#N |r|

BDBM466362

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(cc1F)C#N |r|

BDBM466363

C[C@H](NC(=O)C1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(cc1)C#N |r|

BDBM466364

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(cc1)C#N |r|

BDBM466365

OCC1(CNC(=O)[C@H]2CCN(CC22CC2)c2ncnc3[nH]ccc23)CC(F)(F)C1 |r|

BDBM466366

OC[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C1CCCCC1 |r|

BDBM466367

O[C@@H](CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C1CCC1 |r|

BDBM466368

O=C(NCc1ccc(cc1)C#N)C1CCN(CC11CC1)c1ncnc2[nH]ccc12

BDBM466369

C[C@](CO)(NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(cc1)C#N |r|

BDBM466370

C[C@@](CO)(NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(cc1)C#N |r|

BDBM466371

O[C@@H](CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(cc1)C#N |r|

BDBM466372

OC[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@H](O)c1ccc(F)cn1 |r|

BDBM466373

Fc1cc(ccc1CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C#N |r|

BDBM466375

NS(=O)(=O)c1ccc(CNC(=O)C2CCN(CC22CC2)c2ncnc3[nH]ccc23)cc1

BDBM466376

OC[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(F)cc1F |r|

BDBM466377

OCC1(CNC(=O)C2CCN(CC22CC2)c2ncnc3[nH]ccc23)CC(F)(F)C1

BDBM466378

O[C@@H](CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(cn1)C#N |r|

BDBM466379

Cc1cc(ccc1[C@H](CO)NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C#N |r|

BDBM466380

OC(CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(F)cn1 |r|

BDBM466381

OC(CNC(=O)C1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(cc1)C#N

BDBM466382

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@@H](O)c1ccc(F)c(C)c1 |r|

BDBM466383

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@@H](O)c1ccc(F)cn1 |r|

BDBM466384

OC[C@@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C(=O)OCC1CC(F)(F)C1 |r|

BDBM466385

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@@H](O)c1ccc(cc1)C#N |r|

BDBM466386

Cc1cc(ncc1F)[C@H](O)CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12 |r|

BDBM466387

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@H](O)c1ccc(F)cc1 |r|

BDBM466388

O[C@@H](CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(F)cn1 |r|

BDBM466389

OC[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(cn1)C#N |r|

BDBM466390

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(cn1)C#N |r|

BDBM466391

OC1(CNC(=O)[C@H]2CCN(CC22CC2)c2ncnc3[nH]ccc23)CCCC1 |r|

BDBM466392

OC[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@H](O)c1ccc(F)cc1 |r|

BDBM466393

O[C@H](CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccccc1 |r|

BDBM466394

OCC1(CNC(=O)[C@H]2CCN(CC22CC2)c2ncnc3[nH]ccc23)CCCC1 |r|

BDBM466395

Fc1ccc(CNC(=O)C2CCN(CC22CC2)c2ncnc3[nH]ccc23)cc1

BDBM466396

Cc1cc(ccc1C#N)[C@H](CO)NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12 |r|

BDBM466397

NS(=O)(=O)c1cccc(CNC(=O)C2CCN(CC22CC2)c2ncnc3[nH]ccc23)c1

BDBM466398

FC1(F)CC(CNC(=O)C2CCN(CC22CC2)c2ncnc3[nH]ccc23)C1

BDBM466399

C[C@@](CO)(NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(cn1)C#N |r|

BDBM466400

OCC1(CNC(=O)C2CCN(CC22CC2)c2ncnc3[nH]ccc23)CCCC1

BDBM466401

O=C(NCC1CC(C1)C#N)C1CCN(CC11CC1)c1ncnc2[nH]ccc12 |(3.76,4.62,;2.43,3.85,;1.09,4.62,;-.24,5.39,;-1.58,4.62,;-3.06,5.02,;-3.46,3.53,;-1.97,3.13,;-4.8,2.76,;-6.13,1.99,;2.43,2.31,;1.09,1.54,;1.09,,;2.43,-.77,;3.76,,;3.76,1.54,;5.3,1.54,;4.53,2.87,;2.43,-2.31,;1.09,-3.08,;1.09,-4.62,;2.43,-5.39,;3.76,-4.62,;5.22,-5.1,;6.13,-3.85,;5.22,-2.6,;3.76,-3.08,)|

BDBM466403

FC1(F)CC(CNC(=O)[C@H]2CCN(CC22CC2)c2ncnc3[nH]ccc23)C1 |r|

BDBM466404

O[C@H](CNC(=O)C1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccccc1 |r|

BDBM466405

Cc1ccc(cc1)[C@H](O)CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12 |r|

BDBM466407

OC[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1cccc(c1)C#N |r|

BDBM466408

OC1(CNC(=O)[C@H]2CCN(CC22CC2)c2ncnc3[nH]ccc23)CCC1 |r|

BDBM466409

OC[C@H](NC(=O)C1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccccc1 |r|

BDBM466411

COc1cc(ccc1CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C#N |r|

BDBM466412

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@@H](O)c1ccc(C)cc1 |r|

BDBM466413

OC1(CNC(=O)[C@H]2CCN(CC22CC2)c2ncnc3[nH]ccc23)CCCCC1 |r|

BDBM466414

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@@H](O)c1cc(C)c(F)cn1 |r|

BDBM466416

Cc1cc(F)ccc1[C@H](CO)NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12 |r|

BDBM466417

C[C@](CO)(NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(cn1)C#N |r|

BDBM466418

OC[C@@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C(=O)OCc1ccccc1 |r|

BDBM466419

Fc1cccc(CNC(=O)C2CCN(CC22CC2)c2ncnc3[nH]ccc23)c1

BDBM466420

O=C(NCC1CCCC1)C1CCN(CC11CC1)c1ncnc2[nH]ccc12

BDBM466421

O=C(NC[C@H]1CC[C@@H](C1)C#N)C1CCN(CC11CC1)c1ncnc2[nH]ccc12 |r|

BDBM466422

C[C@@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(C#N)c(F)c1 |r|

BDBM466423

O=C(NCc1ccncc1)C1CCN(CC11CC1)c1ncnc2[nH]ccc12

BDBM466424

C[C@H](NC(=O)C1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1cccc(c1)C#N |r|

BDBM466425

OC[C@@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C(=O)OCC1CCCC1 |r|

BDBM466426

OC1(CNC(=O)C2CCN(CC22CC2)c2ncnc3[nH]ccc23)CCCC1

BDBM466427

CCc1cc(ccc1[C@H](CO)NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C#N |r|

BDBM466428

COc1ccc(CNC(=O)C2CCN(CC22CC2)c2ncnc3[nH]ccc23)cc1

BDBM466429

OC[C@@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C(=O)OCC1CC1 |r|

BDBM466430

COc1cc(CNC(=O)[C@H]2CCN(CC22CC2)c2ncnc3[nH]ccc23)ccc1C#N |r|

BDBM466431

OC[C@@H](NC(=O)C1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(cc1)C#N |r|

BDBM466432

O=C(NCc1ccccc1)C1CCN(CC11CC1)c1ncnc2[nH]ccc12

BDBM466433

OC[C@@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C(=O)OC1CCCC1 |r|

BDBM466434

COc1cc(ccc1[C@H](C)NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C#N |r|

BDBM466435

OC[C@@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C(=O)OCC1(CO)CCC1 |r|

BDBM466436

C[C@H](NC(=O)C1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccccc1 |r|

BDBM466437

OC[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(F)cc1CO |r|

BDBM466438

C[C@@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(cc1F)C#N |r|

BDBM466439

O=C(NC[C@@H]1C[C@H]1C#N)C1CCN(CC11CC1)c1ncnc2[nH]ccc12 |r|

BDBM466440

O[C@@H](CNC(=O)C1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccccc1 |r|

BDBM466441

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@@H](O)c1ccccn1 |r|

BDBM466442

OC[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@@H](O)c1ccc(F)cn1 |r|

BDBM466443

O[C@H](CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1cccc(c1)C#N |r|

BDBM466444

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@H](O)c1ccc(F)cn1 |r|

BDBM466445

OC[C@@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(cn1)C#N |r|

BDBM466446

COc1cc(F)ccc1[C@H](CO)NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12 |r|

BDBM466447

Cc1cc(ncc1F)[C@@H](O)CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12 |r|

BDBM466448

C[C@@H](NC(=O)C1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccc(cc1)C#N |r|

BDBM466449

O=C(NCC1(CC#N)CC1)C1CCN(CC11CC1)c1ncnc2[nH]ccc12

BDBM466451

O=C(NCCc1ccccc1)C1CCN(CC11CC1)c1ncnc2[nH]ccc12

BDBM466452

O=C(NCC1CCC1)C1CCN(CC11CC1)c1ncnc2[nH]ccc12

BDBM466453

OC[C@@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C(=O)OCC1(CO)CC1 |r|

BDBM466455

CC(CO)(NC(=O)C1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccccc1

BDBM466456

COc1cccc(CNC(=O)C2CCN(CC22CC2)c2ncnc3[nH]ccc23)c1

BDBM466457

COc1cc(ccc1[C@H](CO)NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C#N |r|

BDBM466458

CCc1cc(ccc1[C@@H](C)NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C#N |r|

BDBM466459

OC[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccccn1 |r|

BDBM466462

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@H](O)c1ccc(cc1)C#N |r|

BDBM466463

OC[C@@H](NC(=O)C1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccccc1 |r|

BDBM466464

O=C(NCc1cccnc1)C1CCN(CC11CC1)c1ncnc2[nH]ccc12

BDBM466465

OCC1(CNC(=O)[C@H](O)CNC(=O)[C@H]2CCN(CC22CC2)c2ncnc3[nH]ccc23)CC(F)(F)C1 |r|

BDBM466466

O[C@H](CNC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C(=O)NCC1CC(F)(F)C1 |r|

BDBM466468

OC[C@@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C1CCCCC1 |r|

BDBM466469

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@H](O)c1cc(C)c(F)cn1 |r|

BDBM466471

OC[C@@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccccn1 |r|

BDBM466472

C[C@@H](NC(=O)C1CCN(CC11CC1)c1ncnc2[nH]ccc12)c1ccccc1 |r|

BDBM466473

OC[C@@H](Cc1ccccc1)NC(=O)C1CCN(CC11CC1)c1ncnc2[nH]ccc12 |r|

BDBM466474

OC[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C(=O)OCc1ccccc1 |r|

BDBM466476

OC[C@H](Cc1ccccc1)NC(=O)C1CCN(CC11CC1)c1ncnc2[nH]ccc12 |r|

BDBM466480

O=C(NCc1ccc(cc1)C#N)[C@@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12 |r|

BDBM466481

C[C@@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@@H](O)c1ccc(cc1)C#N |r|

BDBM466482

OC[C@@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C1CCC1 |r|

BDBM466483

OC[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)C1CCC1 |r|

BDBM466484

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@@H](O)c1ccc(F)c(F)c1 |r|

BDBM466485

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@@H](O)c1cccc(F)c1 |r|

BDBM466486

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@@H](O)c1cccnc1 |r|

BDBM466487

C[C@H](NC(=O)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12)[C@@H](O)c1ccccc1 |r|

BDBM466488

FC1(F)CC(COC(=O)C2CCN(CC22CC2)c2ncnc3[nH]ccc23)C1

BDBM466489

FC1(F)CC(COC(=O)[C@H]2CCN(CC22CC2)c2ncnc3[nH]ccc23)C1 |r|

BDBM466490

FC1(F)CC(COC(=O)[C@@H]2CCN(CC22CC2)c2ncnc3[nH]ccc23)C1 |r|

BDBM466491

OCC1(COC(=O)[C@H]2CCN(CC22CC2)c2ncnc3[nH]ccc23)CC1 |r|

BDBM466492

OCC1(COC(=O)[C@H]2CCN(CC22CC2)c2ncnc3[nH]ccc23)CCC1 |r|

BDBM466493

OCC1(COC(=O)[C@H]2CCN(CC22CC2)c2ncnc3[nH]ccc23)CCCC1 |r|

BDBM466494

OCC1(COC(=O)[C@H]2CCN(CC22CC2)c2ncnc3[nH]ccc23)CC(F)(F)C1 |r|

BDBM466495

OCC1(COC(=O)[C@H]2CCN(CC22CC2)c2ncnc3[nH]ccc23)CCCCC1 |r|

BDBM466496

OCC1(COC(=O)[C@H]2CCN(CC22CC2)c2ncnc3[nH]ccc23)CS(=O)(=O)C1 |r|

BDBM466497

O=C(OCC1(CC#N)CC1)[C@H]1CCN(CC11CC1)c1ncnc2[nH]ccc12 |r|

BDBM466498

O=C(OCC1(CC#N)CC1)C1CCN(CC11CC1)c1ncnc2[nH]ccc12

BDBM471706

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)C1(CC#N)CC(O)C1 |(7.97,2.67,;6.44,2.83,;5.41,1.68,;4,2.31,;4.16,3.84,;5.67,4.16,;2.67,1.54,;1.33,2.31,;,1.54,;-1.46,2.02,;-2.37,.77,;-1.46,-.48,;;1.33,-.77,;2.67,,;1.33,-2.31,;.09,-3.22,;.56,-4.68,;2.1,-4.68,;2.58,-3.22,;3.01,-5.93,;3.71,-4.55,;5.25,-4.47,;6.78,-4.39,;2.01,-7.1,;3.18,-8.1,;3.3,-9.63,;4.18,-6.93,)|

BDBM472910

CCCN1Cc2[nH]c(nc2C[C@H]1C(=O)N1CCN(CCO)CC1)-c1n[nH]c2cc(ccc12)-c1ccc(O)cc1CC |r|

BDBM350093

CCCN1Cc2[nH]c(nc2C[C@H]1C(=O)N1CCN(CCO)CC1)-c1n[nH]c2cc(ccc12)-c1cc(F)c(O)cc1CC |r|

BDBM472914

CCCN1Cc2[nH]c(nc2C[C@H]1C(=O)N1C[C@@H]2C[C@H]1CN2C)-c1n[nH]c2cc(ccc12)-c1ccc(O)cc1CC |r|

BDBM472916

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc2C[C@H](N(C)Cc2[nH]1)C(=O)N1CCN(C)C[C@@H]1C |r|

BDBM472917

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2C[C@H](N(C)Cc2[nH]1)C(=O)N1CCN(C)C[C@@H]1C |r|

BDBM472918

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc2C[C@H](N(Cc2[nH]1)C(C)C)C(=O)N1CCCN(C)CC1 |r|

BDBM350091

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2C[C@H](N(Cc2[nH]1)C(C)C)C(=O)N1CCCN(C)CC1 |r|

BDBM472922

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc2C[C@H](N(C)Cc2[nH]1)C(=O)N1CCN(CCO)C[C@H]1C |r|

BDBM350092

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2C[C@H](N(C)Cc2[nH]1)C(=O)N1CCN(CCO)C[C@H]1C |r|

BDBM472924

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc2C[C@H](N(Cc2[nH]1)C(C)C)C(=O)N1CC[C@@H](C1)N(C)C |r|

BDBM473560

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc2C[C@H](N(C)Cc2[nH]1)C(=O)N1CCN(C[C@@H]1C)C(=O)OC(C)(C)C |r|

BDBM473564

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc2C[C@H](N(Cc2[nH]1)C(C)C)C(=O)N1CC(C1)N(C)C |r|

BDBM473566

CCN1Cc2[nH]c(nc2C[C@H]1C(=O)N1CC(C1)N(C)C)-c1n[nH]c2cc(ccc12)-c1ccc(O)cc1CC |r|

BDBM473567

CCN1Cc2[nH]c(nc2C[C@H]1C(=O)N1CC(C)(C1)N(C)C)-c1n[nH]c2cc(ccc12)-c1ccc(O)cc1CC |r|

BDBM473568

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc2C[C@H](N(Cc2[nH]1)C(C)C)C(=O)N1CC(C)(C1)N(C)C |r|

BDBM473569

CCCN1Cc2[nH]c(nc2C[C@H]1C(=O)N1CC(C1)N(C)C)-c1n[nH]c2cc(ccc12)-c1ccc(O)cc1CC |r|

BDBM473570

CCCN1Cc2[nH]c(nc2C[C@H]1C(=O)N1CC(C)(C1)N(C)C)-c1n[nH]c2cc(ccc12)-c1ccc(O)cc1CC |r|

BDBM475605

Oc1ccc(cc1)-c1cc(O[C@H]2CCN(C2)C(=O)C=C)c2cncn2c1 |r|

BDBM475606

Oc1ccc(cc1)-c1cc(OCC2CCN(CC2)C(=O)C=C)c2cncn2c1

BDBM475608

Oc1ccc(cc1)-c1cc(OC2CCC22CN(C2)C(=O)C=C)c2cncn2c1

BDBM475609

Oc1ccc(cc1)-c1cc(NC2CCN(CC2)C(=O)C=C)c2cncn2c1

BDBM475611

Oc1ccc(cc1)-c1cn2cncc2c(OCC2CN(C2)C(=O)C=C)n1

BDBM475612

Oc1cc(F)c(c(F)c1)-c1cc(OCC2CN(C2)C(=O)C=C)c2cncn2c1

BDBM475613

Oc1ccc(c(F)c1F)-c1cc(OCC2CN(C2)C(=O)C=C)c2cncn2c1

BDBM475614

COc1cc(cc(Cl)c1O)-c1cc(OCC2CN(C2)C(=O)C=C)c2cncn2c1

BDBM475615

Oc1ccc(cc1)-c1cc(O[C@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C=C)c2cncn2c1 |r,THB:19:18:15.14:11.17.12|

BDBM475616

Oc1ccc(cc1)-c1cc(OCC2CN(C2)C(=O)C=C)c2cncn2c1

BDBM475617

Oc1ccc(cc1Cl)-c1cc(OCC2CN(C2)C(=O)C=C)c2cncn2c1

BDBM475618

CCc1cc(O)c(F)cc1-c1cc(OCC2CN(C2)C(=O)C=C)c2cncn2c1

BDBM475619

Oc1ccc(cc1)-c1cc(OC2CCN(CC2(F)F)C(=O)C=C)c2cncn2c1

BDBM475620

C[C@@H]1C[C@@H](CCN1C(=O)C=C)Oc1cc(cn2cncc12)-c1ccc(O)cc1 |r|

BDBM475623

CCc1cc(O)c(F)cc1-c1cc(O[C@H]2CCCN(C2)C(=O)C=C)c2cncn2c1 |r|

BDBM475627

Oc1ccc(cc1F)-c1cc(OCC2CN(C2)C(=O)C=C)c2cncn2c1

BDBM475628

CCc1cc(O)ccc1-c1cc(OCC2CN(C2)C(=O)C=C)c2cncn2c1

BDBM475630

CN(C)C\C=C\C(=O)N1CC(COc2cc(cn3cncc23)-c2ccc(O)c(Cl)c2)C1

BDBM475631

CCc1cc(O)c(F)cc1-c1cc(OCC2CN(C2)C(=O)\C=C\CN(C)C)c2cncn2c1

BDBM475633

Oc1ccc(cc1)-c1cc(OC[C@H]2CCN(C2)C(=O)C=C)c2cncn2c1 |r|

BDBM475634

Oc1ccc(cc1)-c1cc(O[C@H]2CCCN(C2)C(=O)C=C)c2cncn2c1 |r|

BDBM475635

CC(C)(Oc1cc(cn2cncc12)-c1ccc(O)cc1)C1CN(C1)C(=O)C=C

BDBM475637

Oc1ccc(cc1)-c1cc(OC2CCN(CC2)C(=O)C=C)c2cncn2c1

BDBM475638

Oc1c(F)cc(cc1Cl)-c1cc(OCC2CN(C2)C(=O)C=C)c2cncn2c1

BDBM475641

Cc1cc(ccc1O)-c1cc(OCC2CN(C2)C(=O)C=C)c2cncn2c1

BDBM475644

Oc1ccc(cc1)-c1cc(OC2CC3(C2)CN(C3)C(=O)C=C)c2cncn2c1

BDBM475646

C[C@H]1C[C@@H](CCN1C(=O)C=C)Oc1cc(cn2cncc12)-c1ccc(O)cc1 |r|

BDBM475648

C[C@H]1CN(CC[C@H]1Oc1cc(cn2cncc12)-c1ccc(O)cc1)C(=O)C=C |r|

BDBM475651

Cc1cc(O)ccc1-c1cc(OCC2CN(C2)C(=O)C=C)c2cncn2c1

BDBM475679

C[C@]12CN(CC[C@H]1CCN(C2)c1ncnc2[nH]ccc12)C#N |r|

BDBM475681

C[C@@]12CN(CC[C@@H]1CCN(C2)c1ncnc2[nH]ccc12)C#N |r|

BDBM475682

C[C@]12CN(CC[C@H]1CCN(C2)c1ncnc2[nH]ccc12)c1cnc(cn1)C#N |r|

BDBM475683

C[C@]12CN(CC[C@H]1CCN(C2)c1ncnc2[nH]ccc12)c1ccc(cn1)C#N |r|

BDBM475684

C[C@]12CN(CC[C@H]1CCN(C2)c1ncnc2[nH]ccc12)c1ccc(nn1)C#N |r|

BDBM475685

C[C@]12CN(CC[C@H]1CCN(C2)c1ncnc2[nH]ccc12)c1ncc(cn1)C#N |r|

BDBM475686

Cc1cc(ncc1C#N)N1CC[C@H]2CCN(C[C@@]2(C)C1)c1ncnc2[nH]ccc12 |r|

BDBM475687

C[C@@]12CN(CC[C@@H]1CCN(C2)S(N)(=O)=O)c1ncnc2[nH]ccc12 |r|

BDBM475688

Cc1nc(ccc1C#N)N1CC[C@H]2CCN(C[C@@]2(C)C1)c1ncnc2[nH]ccc12 |r|

BDBM475689

Cc1cc(cnc1N1CC[C@H]2CCN(C[C@@]2(C)C1)c1ncnc2[nH]ccc12)C#N |r|

BDBM475690

Cc1cc(ncc1Br)N1CC[C@H]2CCN(C[C@@]2(C)C1)c1ncnc2[nH]ccc12 |r|

BDBM475691

C[C@@]12CN(CC[C@@H]1CCN(C2)S(C)(=O)=O)c1ncnc2[nH]ccc12 |r|

BDBM475692

Cc1nc(ccc1Br)N1CC[C@H]2CCN(C[C@@]2(C)C1)c1ncnc2[nH]ccc12 |r|

BDBM475693

CC[C@]12CN(CC[C@H]1CCN(C2)c1ncnc2[nH]ccc12)C(C)=O |r|

BDBM475694

CC[C@]12CN(CC[C@H]1CCN(C2)c1ncnc2[nH]ccc12)C=O |r|

BDBM475695

CC[C@@]12CN(CC[C@@H]1CCN(C2)S(N)(=O)=O)c1ncnc2[nH]ccc12 |r|

BDBM475697

CC[C@]12CN(CC[C@H]1CCN(C2)S(N)(=O)=O)c1ncnc2[nH]ccc12 |r|

BDBM475698

CC[C@]12CN(CC[C@H]1CCN(C2)c1ncnc2[nH]ccc12)c1nnc(Br)s1 |r|

BDBM475699

CC[C@@]12CN(CC[C@@H]1CCN(C2)c1ncnc2[nH]ccc12)C#N |r|

BDBM475700

CC[C@]12CN(CC[C@H]1CCN(C2)c1ncnc2[nH]ccc12)C#N |r|

BDBM475702

CCC12CNCCC1CCN(C2)c1ncnc2[nH]ccc12

BDBM475703

CC[C@]12CN(CCC1CCN(C2)c1ncnc2[nH]ccc12)c1nc(cs1)C#N |r|

BDBM475704

C[C@]12CN(C[C@H]1CCN(C2)c1ncnc2[nH]ccc12)S(C)(=O)=O |r|

BDBM475705

C[C@]12CN(C[C@H]1CCN(C2)c1ncnc2[nH]ccc12)S(N)(=O)=O |r|

BDBM475706

C[C@@]12CN(C[C@@H]1CCN(C2)c1ncnc2[nH]ccc12)C#N |r|

BDBM475707

C[C@]12CN(C[C@H]1CCN(C2)c1ncnc2[nH]ccc12)C#N |r|

BDBM475708

C[C@]12CN(C[C@H]1CCN(C2)c1ncnc2[nH]ccc12)S(=O)(=O)NCC#N |r|

BDBM475709

C[C@]12CN(C[C@H]1CCN(C2)c1ncnc2[nH]ccc12)S(=O)(=O)CC(F)(F)F |r|

BDBM475710

C[C@]12CN(C[C@H]1CCN(C2)c1ncnc2[nH]ccc12)C(=O)CC#N |r|

BDBM475711

C[C@]12CN(C[C@H]1CCN(C2)c1ncnc2[nH]ccc12)c1ccc(cn1)C#N |r|

BDBM475712

C[C@@]12CN(C[C@@H]1CCN(C2)c1ncnc2[nH]ccc12)c1ccc(cn1)C#N |r|

BDBM475713

C[C@]12CN(C[C@H]1CCN(C2)c1ncnc2[nH]ccc12)c1ccc(cn1)S(C)(=O)=O |r|

BDBM475714

C[C@]12CN(C[C@H]1CCN(C2)c1ncnc2[nH]ccc12)c1ncccc1CO |r|

BDBM475715

C[C@]12CN(C[C@H]1CCN(C2)c1ncnc2[nH]ccc12)c1ncc(Br)cc1CO |r|

BDBM475716

C[C@]12CN(C[C@H]1CCN(C2)c1ncnc2[nH]ccc12)c1ccc(cc1)S(C)(=O)=O |r|

BDBM475717

C[C@]12CN(C[C@H]1CCN(C2)c1ncnc2[nH]ccc12)c1ccncn1 |r|

BDBM475718

Cc1cc(ncc1C#N)N1C[C@H]2CCN(C[C@@]2(C)C1)c1ncnc2[nH]ccc12 |r|

BDBM475719

C[C@]12CN(C[C@H]1CCN(C2)c1ncnc2[nH]ccc12)c1ncc(cn1)C#N |r|

BDBM475720

C[C@]12CN(C[C@H]1CCN(C2)c1ncnc2[nH]ccc12)c1ccc(nn1)C#N |r|

BDBM475721

C[C@]12CN(C[C@H]1CCN(C2)c1ncnc2[nH]ccc12)c1cnc(cn1)C#N |r|

BDBM475722

Cc1cc(cnc1N1C[C@H]2CCN(C[C@@]2(C)C1)c1ncnc2[nH]ccc12)C#N |r|

BDBM475723

Cc1nc(ccc1C#N)N1C[C@H]2CCN(C[C@@]2(C)C1)c1ncnc2[nH]ccc12 |r|

BDBM475724

C[C@]12CN(C[C@H]1CCN(C2)c1ncnc2[nH]ccc12)C(=O)C1(CCCC1)C#N |r|

BDBM474456

CS(=O)(=O)c1ccc(Nc2oc(nc2C(N)=O)-c2c(F)cccc2F)cc1

BDBM474462

NC(=O)c1nc(oc1Nc1ccc(cc1)S(N)(=O)=O)-c1c(F)cccc1F

BDBM474463

CN(C)S(=O)(=O)c1ccc(Nc2oc(nc2C(N)=O)-c2c(F)cccc2F)cc1

BDBM474464

CNS(=O)(=O)c1ccc(Nc2oc(nc2C(N)=O)-c2c(F)cccc2F)cc1

BDBM474465

CN(C)C(=O)c1ccc(Nc2oc(nc2C(N)=O)-c2c(F)cccc2F)cc1

BDBM474466

NCCCNC(=O)c1ccc(Nc2oc(nc2C(N)=O)-c2c(F)cccc2F)cc1

BDBM474467

NC(=O)c1nc(oc1Nc1ccc(cc1)C(=O)N[C@@H]1CCCNC1)-c1c(F)cccc1F |r|

BDBM474470

NC(=O)c1nc(oc1Nc1ccc(cc1)C(=O)N[C@H]1CCCNC1)-c1c(F)cccc1F |r|

BDBM474472

NC(=O)c1nc(oc1Nc1ccc(cc1)C(=O)N1CCOCC1)-c1c(F)cccc1F

BDBM474473

CNCCNC(=O)c1ccc(Nc2oc(nc2C(N)=O)-c2c(F)cccc2F)cc1

BDBM474474

CNCCCNC(=O)c1ccc(Nc2oc(nc2C(N)=O)-c2c(F)cccc2F)cc1

BDBM474475

NC(=O)c1nc(oc1Nc1ccc(cc1)C(=O)N[C@@H]1CCNC1)-c1c(F)cccc1F |r|

BDBM474476

NC(=O)c1nc(oc1Nc1ccc(cc1)C(=O)N[C@H]1CCNC1)-c1c(F)cccc1F |r|

BDBM474477

NC(=O)c1nc(oc1Nc1ccc(cc1)C(=O)N1CCC[C@@H]1CO)-c1c(F)cccc1F |r|

BDBM474478

NC(=O)c1nc(oc1Nc1ccc(cc1)C(=O)NCCO)-c1c(F)cccc1F

BDBM474479

NC(=O)c1nc(oc1Nc1ccc(cc1)C(=O)NCCCO)-c1c(F)cccc1F

BDBM474480

NC(=O)c1nc(oc1Nc1ccc(cc1)C(=O)NC1CCNCC1)-c1c(F)cccc1F

BDBM474481

CN1CCC(CC1)NC(=O)c1ccc(Nc2oc(nc2C(N)=O)-c2c(F)cccc2F)cc1

BDBM474482

CS(=O)(=O)c1ccc(Nc2oc(nc2C(N)=O)-c2c(Cl)cccc2Cl)cc1

BDBM474483

CS(=O)(=O)c1ccc(Nc2oc(nc2C(N)=O)-c2c(F)cccc2Cl)cc1

BDBM474484

CS(=O)(=O)c1ccc(Nc2oc(nc2C(N)=O)-c2c(F)cc(F)cc2F)cc1

BDBM474485

CS(=O)(=O)c1ccc(Nc2oc(nc2C(N)=O)-c2cc(F)ccc2F)cc1

BDBM477065

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CCN(Cc2[nH]1)C(=O)c1cnc(cn1)N1CCCCC1

BDBM477066

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCc2[nH]1)C(=O)N1CCOCC1

BDBM477067

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCc2[nH]1)C(=O)N1CCC(CC1)N1CCCCC1

BDBM333144

CCN1Cc2[nH]c(nc2C[C@H]1C(=O)N1CC(C1)N(C)C)-c1n[nH]c2cc(ccc12)-c1cc(F)c(O)cc1CC |r|

BDBM333145

CCN1Cc2[nH]c(nc2C[C@H]1C(=O)N1CC(C)(C1)N(C)C)-c1n[nH]c2cc(ccc12)-c1cc(F)c(O)cc1CC |r|

BDBM333121

CCCN1Cc2[nH]c(nc2C[C@H]1C(=O)N1CC(C1)N(C)C)-c1n[nH]c2cc(ccc12)-c1cc(F)c(O)cc1CC |r|

BDBM487162

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CCC(=O)CO)n2)n[nH]1 |r,TLB:23:22:19.18:16.15.21|

BDBM487181

CC(C#N)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:1:4:7.6:11.10.9|

BDBM487182

CCC(C#N)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |r,TLB:2:5:8.7:12.11.10|

BDBM487211

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CC3CCOC3=O)n2)n[nH]1 |THB:24:23:18.19.20:15.16.22|

BDBM487212

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C[C@@H]3CCOC3=O)n2)n[nH]1 |THB:24:23:18.19.20:15.16.22|

BDBM487213

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CC3CCCOC3=O)n2)n[nH]1 |THB:24:23:18.19.20:15.16.22|

BDBM487217

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CC3CCC(=O)O3)n2)n[nH]1 |THB:24:23:18.19.20:15.16.22|

BDBM487234

CSC(C)C(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |TLB:4:6:8.9.10:12.13.14|

BDBM487236

CCSC(C)C(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |TLB:5:7:9.10.11:13.14.15|

BDBM487287

CCS(=O)(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2nc(OC)ccc12 |r,TLB:2:5:8.7:12.11.10|

BDBM487291

CCS(=O)(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2nc(CO)ccc12 |r,TLB:2:5:8.7:12.11.10|

BDBM487303

Cc1cc(Nc2cc3nc(CN4CCOCC4)ccc3c(N[C@@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)OCC=C)n2)n[nH]1 |THB:31:30:27.26.25:22.29.23|

BDBM487304

Cc1cc(Nc2cc3nc(CN4CCOCC4)ccc3c(N[C@@H]3C[C@@H]4CCC[C@H](C3)N4CCC#N)n2)n[nH]1 |THB:31:30:27.26.25:22.29.23|

BDBM487307

Cc1cc(Nc2cc3nc(CN4CCOCC4)ccc3c(N[C@@H]3C[C@@H]4CCC[C@H](C3)N4CC(F)(F)F)n2)n[nH]1 |THB:31:30:27.26.25:22.29.23|

BDBM487345

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)c3ccncc3)c2c1 |r,TLB:26:25:22.21:19.18.24|

BDBM487358

COC(=O)c1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CF)c2c1 |r,TLB:28:27:24.23:21.20.26|

BDBM487368

COC(=O)c1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4CCC#N)c2c1 |THB:29:28:23.24.25:20.21.27|

BDBM487369

COC(=O)c1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C3CCOC(=O)C3)c2c1 |THB:29:28:23.24.25:20.21.27|

BDBM487370

COC(=O)c1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C[C@H]3CCC(=O)O3)c2c1 |THB:29:28:23.24.25:20.21.27|

BDBM487395

Cc1cc(Nc2nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4Cc3ccncc3)c3cccnc3c2F)n[nH]1 |r,TLB:18:17:14.13.12:10.9.16|

BDBM489711

CCCS(=O)(=O)N[C@H]1CCC(C1)N(C)c1ncnc2[nH]ccc12 |r|

BDBM489746

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)c1cccc2nonc12)c1ncnc2[nH]ccc12 |r,wU:2.1,4.6,(-6.03,.77,;-4.7,0,;-3.37,.77,;-1.88,.38,;-1.48,1.86,;-2.97,2.26,;-.15,2.63,;1.19,1.86,;.42,.53,;1.96,.53,;2.52,2.63,;2.84,4.14,;4.3,4.62,;5.45,3.59,;5.13,2.08,;6.03,.83,;5.13,-.41,;3.66,.06,;3.66,1.6,;-4.7,-1.54,;-6.03,-2.31,;-6.03,-3.85,;-4.7,-4.62,;-3.37,-3.85,;-1.9,-4.32,;-1,-3.08,;-1.9,-1.83,;-3.37,-2.31,)|

BDBM489747

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)CC1(C)COC1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(-5.61,1.41,;-4.28,.64,;-2.94,1.41,;-2.55,2.89,;-1.06,2.5,;-1.46,1.01,;.28,3.27,;1.61,2.5,;.84,1.16,;2.38,1.16,;2.94,3.27,;4.28,2.5,;4.68,3.98,;3.51,1.16,;4.84,.39,;5.61,1.73,;-4.28,-.9,;-5.61,-1.67,;-5.61,-3.21,;-4.28,-3.98,;-2.94,-3.21,;-1.48,-3.69,;-.57,-2.44,;-1.48,-1.2,;-2.94,-1.67,)|

BDBM489748

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)[C@H]1C[C@@H]1CC#N)c1ncnc2[nH]ccc12 |r,wU:10.10,wD:2.1,4.6,12.14,(-5.71,1.1,;-4.38,.33,;-3.05,1.1,;-2.65,2.59,;-1.16,2.19,;-1.56,.7,;.17,2.96,;1.51,2.19,;1.51,.65,;.17,1.42,;2.84,2.96,;3.61,4.29,;4.38,2.96,;5.71,2.19,;5.71,.65,;5.71,-.89,;-4.38,-1.21,;-5.71,-1.98,;-5.71,-3.52,;-4.38,-4.29,;-3.05,-3.52,;-1.58,-4,;-.68,-2.75,;-1.58,-1.51,;-3.05,-1.98,)|

BDBM489749

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)[C@@H]1C[C@H]1CC#N)c1ncnc2[nH]ccc12 |r,wU:12.14,wD:2.1,4.6,10.10,(-7.05,1.1,;-5.71,.33,;-4.38,1.1,;-3.98,2.59,;-2.49,2.19,;-2.89,.7,;-1.16,2.96,;.17,2.19,;-.6,.85,;.94,.85,;1.51,2.96,;2.28,4.29,;3.05,2.96,;4.38,2.19,;5.71,2.96,;7.05,3.73,;-5.71,-1.21,;-7.05,-1.98,;-7.05,-3.52,;-5.71,-4.29,;-4.38,-3.52,;-2.92,-4,;-2.01,-2.75,;-2.92,-1.51,;-4.38,-1.98,)|

BDBM489750

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)N1CC(C)(C1)C#N)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(-5.99,-.11,;-4.66,-.88,;-3.32,-.11,;-2.92,1.37,;-1.44,.98,;-1.84,-.51,;-.1,1.75,;1.23,.98,;.46,-.36,;2,-.36,;2.56,1.75,;4.05,1.35,;4.45,2.84,;5.99,2.84,;2.96,3.23,;5.22,4.17,;5.99,5.5,;-4.66,-2.42,;-5.99,-3.19,;-5.99,-4.73,;-4.66,-5.5,;-3.32,-4.73,;-1.86,-5.21,;-.95,-3.96,;-1.86,-2.72,;-3.32,-3.19,)|

BDBM489751

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)[C@H]1CC[C@@H](C1)C#N)c1ncnc2[nH]ccc12 |r,wU:13.16,wD:2.1,4.6,10.10,(-5.78,-.58,;-4.45,-1.35,;-3.11,-.58,;-2.71,.91,;-1.23,.51,;-1.62,-.97,;.11,1.28,;1.44,.51,;.67,-.82,;2.21,-.82,;2.77,1.28,;4.24,.81,;5.14,2.05,;4.24,3.3,;2.77,2.82,;5.01,4.63,;5.78,5.97,;-4.45,-2.89,;-5.78,-3.66,;-5.78,-5.2,;-4.45,-5.97,;-3.11,-5.2,;-1.65,-5.67,;-.74,-4.43,;-1.65,-3.18,;-3.11,-3.66,)|

BDBM489752

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)[C@@H]1CC[C@@H](C1)C#N)c1ncnc2[nH]ccc12 |r,wU:10.10,13.16,wD:2.1,4.6,(-5.78,-.58,;-4.45,-1.35,;-3.11,-.58,;-2.71,.91,;-1.23,.51,;-1.62,-.97,;.11,1.28,;1.44,.51,;.67,-.82,;2.21,-.82,;2.77,1.28,;4.24,.81,;5.14,2.05,;4.24,3.3,;2.77,2.82,;5.01,4.63,;5.78,5.97,;-4.45,-2.89,;-5.78,-3.66,;-5.78,-5.2,;-4.45,-5.97,;-3.11,-5.2,;-1.65,-5.67,;-.74,-4.43,;-1.65,-3.18,;-3.11,-3.66,)|

BDBM489753

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)[C@H]1CC[C@H](C1)C#N)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,10.10,13.16,(-7,.61,;-5.67,-.16,;-4.33,.61,;-3.94,2.1,;-2.45,1.7,;-2.85,.21,;-1.11,2.47,;.43,2.47,;.43,4.01,;.43,.93,;1.97,2.47,;2.87,1.22,;4.33,1.7,;4.33,3.24,;2.87,3.72,;5.67,4.01,;7,4.78,;-5.67,-1.7,;-7,-2.47,;-7,-4.01,;-5.67,-4.78,;-4.33,-4.01,;-2.87,-4.49,;-1.97,-3.24,;-2.87,-1.99,;-4.33,-2.47,)|

BDBM489755

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)[C@@H]1CC[C@H](C1)C#N)c1ncncc1C=C |r,wU:10.10,wD:2.1,4.6,13.16,(-5.78,-.58,;-4.45,-1.35,;-3.11,-.58,;-2.71,.91,;-1.23,.51,;-1.62,-.97,;.11,1.28,;1.44,.51,;.67,-.82,;2.21,-.82,;2.77,1.28,;4.24,.81,;5.14,2.05,;4.24,3.3,;2.77,2.82,;5.01,4.63,;5.78,5.97,;-4.45,-2.89,;-5.78,-3.66,;-5.78,-5.2,;-4.45,-5.97,;-3.11,-5.2,;-3.11,-3.66,;-1.62,-3.26,;-.85,-4.59,)|

BDBM489756

CN([C@@H]1C[C@H](CS(=O)(=O)N2CC(C2)C#N)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.55,.45,;-5.22,-.32,;-3.89,.45,;-3.49,1.94,;-2,1.54,;-.67,2.31,;.67,1.54,;-.1,.21,;1.44,.21,;2,2.31,;3.49,1.91,;3.89,3.4,;2.4,3.8,;5.22,4.17,;6.55,4.94,;-2.4,.05,;-5.22,-1.86,;-6.55,-2.63,;-6.55,-4.17,;-5.22,-4.94,;-3.89,-4.17,;-2.42,-4.64,;-1.52,-3.4,;-2.42,-2.15,;-3.89,-2.63,)|

BDBM489757

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)[C@@H]1C[C@@H](C1)C#N)c1ncnc2[nH]ccc12 |r,wU:10.10,12.15,wD:2.1,4.6,(-6.55,.45,;-5.22,-.32,;-3.89,.45,;-3.49,1.94,;-2,1.54,;-2.4,.05,;-.67,2.31,;.67,1.54,;-.1,.21,;1.44,.21,;2,2.31,;3.49,1.91,;3.89,3.4,;2.4,3.8,;5.22,4.17,;6.55,4.94,;-5.22,-1.86,;-6.55,-2.63,;-6.55,-4.17,;-5.22,-4.94,;-3.89,-4.17,;-2.42,-4.64,;-1.52,-3.4,;-2.42,-2.15,;-3.89,-2.63,)|

BDBM489758

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)[C@H]1C[C@@H](C1)C#N)c1ncnc2[nH]ccc12 |r,wU:10.10,wD:2.1,4.6,12.15,(-6.55,.45,;-5.22,-.32,;-3.89,.45,;-3.49,1.94,;-2,1.54,;-2.4,.05,;-.67,2.31,;.67,1.54,;-.1,.21,;1.44,.21,;2,2.31,;2.4,3.8,;3.89,3.4,;3.49,1.91,;5.22,4.17,;6.55,4.94,;-5.22,-1.86,;-6.55,-2.63,;-6.55,-4.17,;-5.22,-4.94,;-3.89,-4.17,;-2.42,-4.64,;-1.52,-3.4,;-2.42,-2.15,;-3.89,-2.63,)|

BDBM489759

CN([C@@H]1C[C@H](CS(=O)(=O)[C@@H]2C[C@@H](C2)C#N)C1)c1ncnc2[nH]ccc12 |r,wU:2.1,4.4,wD:9.8,11.13,(-6.55,-1.48,;-5.22,-.71,;-3.89,-1.48,;-3.49,-2.97,;-2,-2.57,;-.67,-3.34,;.67,-2.57,;-.1,-1.24,;1.44,-3.91,;2,-1.8,;2.4,-.32,;3.89,-.71,;3.49,-2.2,;5.22,.06,;6.55,.83,;-2.4,-1.09,;-5.22,.83,;-6.55,1.6,;-6.55,3.14,;-5.22,3.91,;-3.89,3.14,;-2.42,3.61,;-1.52,2.37,;-2.42,1.12,;-3.89,1.6,)|

BDBM489760

CN([C@@H]1C[C@H](CS(=O)(=O)CC2(C)COC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.03,1.61,;-4.7,.84,;-3.37,1.61,;-2.97,3.09,;-1.48,2.7,;-.15,3.47,;1.19,2.69,;.42,1.36,;1.96,1.36,;2.52,3.46,;3.86,2.69,;2.77,1.61,;4.94,1.61,;6.03,2.69,;4.94,3.78,;-1.88,1.21,;-4.7,-.7,;-6.03,-1.47,;-6.03,-3.01,;-4.7,-3.78,;-3.37,-3.01,;-1.9,-3.49,;-1,-2.24,;-1.9,-1,;-3.37,-1.47,)|

BDBM489790

CN([C@@H]1C[C@H](CS(=O)(=O)N2CC(C)(C2)C#N)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.99,-.11,;-4.66,-.88,;-3.32,-.11,;-2.92,1.37,;-1.44,.98,;-.1,1.75,;1.23,.98,;.46,-.36,;2,-.36,;2.56,1.75,;4.05,1.35,;4.45,2.84,;5.99,2.84,;2.96,3.23,;5.22,4.17,;5.99,5.5,;-1.84,-.51,;-4.66,-2.42,;-5.99,-3.19,;-5.99,-4.73,;-4.66,-5.5,;-3.32,-4.73,;-1.86,-5.21,;-.95,-3.96,;-1.86,-2.72,;-3.32,-3.19,)|

BDBM489791

CN([C@@H]1C[C@H](CS(=O)(=O)C2C[C@@H](C2)C#N)C1)c1ncnc2[nH]ccc12 |r,wU:11.13,wD:2.1,4.4,(-6.55,.45,;-5.22,-.32,;-3.89,.45,;-3.49,1.94,;-2,1.54,;-.67,2.31,;.67,1.54,;-.1,.21,;1.44,.21,;2,2.31,;3.49,1.91,;3.89,3.4,;2.4,3.8,;5.22,4.17,;6.55,4.94,;-2.4,.05,;-5.22,-1.86,;-6.55,-2.63,;-6.55,-4.17,;-5.22,-4.94,;-3.89,-4.17,;-2.42,-4.64,;-1.52,-3.4,;-2.42,-2.15,;-3.89,-2.63,)|

BDBM489792

CN([C@@H]1C[C@H](CS(=O)(=O)N2C[C@@H]3C[C@@]3(C2)C#N)C1)c1ncnc2[nH]ccc12 |r,wU:11.11,wD:2.1,4.4,13.16,(-5.78,-.78,;-4.44,-1.55,;-3.11,-.78,;-2.71,.71,;-1.22,.31,;.11,1.08,;1.45,.31,;.68,-1.03,;2.22,-1.03,;2.78,1.08,;4.24,.6,;5.15,1.85,;5.78,3.25,;4.24,3.09,;2.78,2.62,;4.24,4.63,;4.24,6.17,;-1.62,-1.18,;-4.44,-3.09,;-5.78,-3.86,;-5.78,-5.4,;-4.44,-6.17,;-3.11,-5.4,;-1.64,-5.88,;-.74,-4.63,;-1.64,-3.39,;-3.11,-3.86,)|

BDBM489793

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)[C@@H]1C[C@@H](C1)C(F)F)c1ncnc2[nH]ccc12 |r,wU:2.1,4.6,wD:10.10,12.15,(-6.55,-1.48,;-5.22,-.71,;-3.89,-1.48,;-3.49,-2.97,;-2,-2.57,;-2.4,-1.09,;-.67,-3.34,;.67,-2.57,;-.1,-1.24,;1.44,-3.91,;2,-1.8,;2.4,-.32,;3.89,-.71,;3.49,-2.2,;5.22,.06,;5.22,1.6,;6.55,-.71,;-5.22,.83,;-6.55,1.6,;-6.55,3.14,;-5.22,3.91,;-3.89,3.14,;-2.42,3.61,;-1.52,2.37,;-2.42,1.12,;-3.89,1.6,)|

BDBM489794

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)[C@H]1C[C@@H](C1)C(F)F)c1ncnc2[nH]ccc12 |r,wU:2.1,4.6,12.15,wD:10.10,(-6.55,-1.48,;-5.22,-.71,;-3.89,-1.48,;-3.49,-2.97,;-2,-2.57,;-2.4,-1.09,;-.67,-3.34,;.67,-2.57,;-.1,-1.24,;1.44,-3.91,;2,-1.8,;3.49,-2.2,;3.89,-.71,;2.4,-.32,;5.22,.06,;6.55,-.71,;5.22,1.6,;-5.22,.83,;-6.55,1.6,;-6.55,3.14,;-5.22,3.91,;-3.89,3.14,;-2.42,3.61,;-1.52,2.37,;-2.42,1.12,;-3.89,1.6,)|

BDBM489795

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)C[C@@]1(C)C[C@H](CN)C1)c1ncnc2[nH]ccc12 |r,wU:11.12,14.15,wD:2.1,4.6,11.11,(-7.12,1.06,;-5.79,.29,;-4.45,1.06,;-4.06,2.55,;-2.57,2.15,;-2.97,.66,;-1.23,2.92,;.1,2.15,;-.67,.82,;.87,.82,;1.43,2.92,;2.77,2.15,;1.68,1.06,;3.86,1.06,;4.94,2.15,;6.03,3.24,;7.12,4.33,;3.86,3.24,;-5.79,-1.25,;-7.12,-2.02,;-7.12,-3.56,;-5.79,-4.33,;-4.45,-3.56,;-2.99,-4.03,;-2.08,-2.79,;-2.99,-1.54,;-4.45,-2.02,)|

BDBM489796

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)C[C@]1(C)C[C@@H](C1)C#N)c1ncnc2[nH]ccc12 |r,wU:11.12,wD:2.1,4.6,11.11,14.17,(-7.05,1.18,;-5.71,.41,;-4.38,1.18,;-4.38,2.72,;-2.84,2.72,;-2.84,1.18,;-1.51,3.49,;-.17,2.72,;-.94,1.39,;.6,1.39,;1.16,3.49,;2.49,2.72,;2.89,4.21,;3.98,3.12,;4.38,1.63,;2.89,1.23,;5.71,.86,;7.05,.09,;-5.71,-1.13,;-7.05,-1.9,;-7.05,-3.44,;-5.71,-4.21,;-4.38,-3.44,;-2.92,-3.91,;-2.01,-2.67,;-2.92,-1.42,;-4.38,-1.9,)|

BDBM489797

CN([C@@H]1C[C@H](CS(=O)(=O)N2CC(C2)C(F)F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.53,1.1,;-5.2,.33,;-3.86,1.1,;-3.46,2.59,;-1.98,2.19,;-.64,2.96,;.69,2.19,;-.08,.85,;1.46,.85,;2.02,2.96,;3.13,1.87,;4.22,2.96,;3.13,4.05,;5.76,2.96,;6.53,4.29,;6.53,1.62,;-2.37,.7,;-5.2,-1.21,;-6.53,-1.98,;-6.53,-3.52,;-5.2,-4.29,;-3.86,-3.52,;-2.4,-4,;-1.49,-2.75,;-2.4,-1.51,;-3.86,-1.98,)|

BDBM489798

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)[C@H]1C[C@H](F)C1)c1ncnc2[nH]ccc12 |r,wU:10.10,wD:2.1,4.6,12.13,(-6.03,1.22,;-4.7,.45,;-3.37,1.22,;-2.97,2.71,;-1.48,2.31,;-1.88,.82,;-.15,3.08,;1.19,2.31,;.42,.98,;1.96,.98,;2.52,3.08,;3.61,4.17,;4.7,3.08,;6.03,3.85,;3.61,1.99,;-4.7,-1.09,;-6.03,-1.86,;-6.03,-3.4,;-4.7,-4.17,;-3.37,-3.4,;-1.9,-3.87,;-1,-2.63,;-1.9,-1.38,;-3.37,-1.86,)|

BDBM489799

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)[C@@H]1C[C@H](F)C1)c1ncnc2[nH]ccc12 |r,wU:10.10,12.13,wD:2.1,4.6,(-6.11,1.22,;-4.78,.45,;-3.44,1.22,;-3.04,2.71,;-1.56,2.31,;-1.96,.82,;-.22,3.08,;1.11,2.31,;.34,.98,;1.88,.98,;2.44,3.08,;3.53,1.99,;4.62,3.08,;6.11,3.48,;3.53,4.17,;-4.78,-1.09,;-6.11,-1.86,;-6.11,-3.4,;-4.78,-4.17,;-3.44,-3.4,;-1.98,-3.87,;-1.07,-2.63,;-1.98,-1.38,;-3.44,-1.86,)|

BDBM489800

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)N1CC(CC(F)F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(-7.38,1,;-6.04,.23,;-4.71,1,;-4.31,2.48,;-2.82,2.08,;-3.22,.6,;-1.49,2.85,;-.15,2.08,;-.92,.75,;.62,.75,;1.18,2.85,;2.29,1.77,;3.37,2.85,;4.71,2.08,;6.04,2.85,;7.38,2.08,;6.04,4.39,;2.29,3.94,;-6.04,-1.31,;-7.38,-2.08,;-7.38,-3.62,;-6.04,-4.39,;-4.71,-3.62,;-3.24,-4.1,;-2.34,-2.85,;-3.24,-1.61,;-4.71,-2.08,)|

BDBM489801

CN([C@@H]1C[C@H](CS(=O)(=O)C[C@H]2C[C@@H](C2)C#N)C1)c1ncnc2[nH]ccc12 |r,wU:12.14,wD:2.1,4.4,10.9,(-6.93,1.38,;-5.59,.61,;-4.26,1.38,;-4.26,2.92,;-2.72,2.92,;-1.63,4.01,;-.3,3.24,;-1.07,1.91,;.47,1.91,;1.04,4.01,;2.37,3.24,;2.77,1.75,;4.26,2.15,;3.86,3.64,;5.59,1.38,;6.93,.61,;-2.72,1.38,;-5.59,-.93,;-6.93,-1.7,;-6.93,-3.24,;-5.59,-4.01,;-4.26,-3.24,;-2.79,-3.72,;-1.89,-2.47,;-2.79,-1.22,;-4.26,-1.7,)|

BDBM489802

CN([C@@H]1C[C@H](CS(=O)(=O)C[C@H]2C[C@H](C2)C#N)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,10.9,12.14,(-6.93,1.38,;-5.59,.61,;-4.26,1.38,;-4.26,2.92,;-2.72,2.92,;-1.63,4.01,;-.3,3.24,;-1.07,1.91,;.47,1.91,;1.04,4.01,;2.37,3.24,;2.77,1.75,;4.26,2.15,;3.86,3.64,;5.59,1.38,;6.93,.61,;-2.72,1.38,;-5.59,-.93,;-6.93,-1.7,;-6.93,-3.24,;-5.59,-4.01,;-4.26,-3.24,;-2.79,-3.72,;-1.89,-2.47,;-2.79,-1.22,;-4.26,-1.7,)|

BDBM489803

CN([C@@H]1C[C@H](CS(=O)(=O)N2CC(COC(F)F)C2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-4.94,2.31,;-3.61,1.54,;-2.28,2.31,;-1.88,3.8,;-.39,3.4,;.94,4.17,;2.28,3.4,;3.61,4.17,;2.28,4.94,;2.28,1.86,;1.19,.77,;2.28,-.32,;2.28,-1.86,;3.61,-2.63,;3.61,-4.17,;4.94,-4.94,;2.28,-4.94,;3.37,.77,;-.79,1.91,;-3.61,,;-4.94,-.77,;-4.94,-2.31,;-3.61,-3.08,;-2.28,-2.31,;-.81,-2.79,;.09,-1.54,;-.81,-.29,;-2.28,-.77,)|

BDBM489804

CN([C@@H]1C[C@H](CS(=O)(=O)N(C)C23CC(C2)C3)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-3.72,-3.4,;-2.39,-2.63,;-2.39,-1.09,;-3.47,,;-2.39,1.09,;-2.39,2.63,;-1.05,3.4,;-1.05,4.94,;.28,2.63,;.28,4.17,;.28,5.71,;1.62,3.4,;2.43,2.58,;3.72,2.84,;2.39,2.07,;2.95,4.17,;-1.3,,;-1.05,-3.4,;-1.05,-4.94,;.28,-5.71,;1.62,-4.94,;1.62,-3.4,;2.76,-2.37,;2.13,-.96,;.6,-1.12,;.28,-2.63,)|

BDBM489806

COCC1CCN(C1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,w:3.2,wU:12.12,14.17,(-4.2,-5.11,;-4.2,-3.57,;-5.53,-2.8,;-5.53,-1.26,;-6.78,-.36,;-6.3,1.11,;-4.76,1.11,;-4.29,-.36,;-3.99,2.44,;-5.33,3.21,;-2.66,1.67,;-3.22,3.78,;-1.68,3.78,;-.6,4.87,;.49,3.78,;-.6,2.69,;2.03,3.78,;2.8,5.11,;2.8,2.44,;2.03,1.11,;2.8,-.22,;4.34,-.22,;5.11,1.11,;6.62,1.43,;6.78,2.96,;5.37,3.59,;4.34,2.44,)|

BDBM489807

CN([C@@H]1C[C@H](CS(=O)(=O)N2CC3C(C2)C3C(F)(F)F)C1)c1ncnc2[nH]ccc12 |r,w:10.10,12.12,wU:4.4,2.1,(3.94,4.83,;3.17,3.5,;1.63,3.5,;.54,4.59,;-.55,3.5,;-2.09,3.5,;-2.86,2.16,;-4.2,2.93,;-1.53,1.39,;-3.63,.83,;-5.17,.83,;-5.65,-.63,;-4.4,-1.54,;-3.16,-.63,;-5.81,-2.16,;-6.58,-3.5,;-7.91,-2.73,;-7.35,-4.83,;-5.25,-4.27,;.54,2.41,;3.94,2.16,;3.17,.83,;3.94,-.5,;5.48,-.5,;6.25,.83,;7.75,1.15,;7.91,2.68,;6.51,3.31,;5.48,2.16,)|

BDBM489808

C[C@@H]1CN(CCO1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:11.11,13.16,wD:1.0,(-7.7,-2,;-6.16,-2,;-5.39,-.67,;-3.85,-.67,;-3.08,-2,;-3.85,-3.33,;-5.39,-3.33,;-3.08,.67,;-4.41,1.44,;-1.74,-.1,;-2.31,2,;-.77,2,;.32,3.09,;1.41,2,;.32,.91,;2.95,2,;3.72,3.33,;3.72,.67,;2.95,-.67,;3.72,-2,;5.26,-2,;6.03,-.67,;7.54,-.35,;7.7,1.18,;6.29,1.81,;5.26,.67,)|

BDBM489811

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCC(F)CC2)C1)c1ncnc2[nH]ccc12 |r,wU:4.4,2.1,(2.95,4,;2.18,2.67,;.64,2.67,;-.45,3.76,;-1.54,2.67,;-3.08,2.67,;-3.85,1.33,;-5.18,2.1,;-2.51,.56,;-4.62,,;-6.16,,;-6.93,-1.33,;-6.16,-2.67,;-6.93,-4,;-4.62,-2.67,;-3.85,-1.33,;-.45,1.58,;2.95,1.33,;2.18,,;2.95,-1.33,;4.49,-1.33,;5.26,,;6.77,.32,;6.93,1.85,;5.52,2.48,;4.49,1.33,)|

BDBM489812

COCC1CN(CCO1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,w:3.2,wU:13.13,15.18,(-8.85,-3.33,;-7.31,-3.33,;-6.54,-2,;-5,-2,;-4.23,-.67,;-2.69,-.67,;-1.92,-2,;-2.69,-3.33,;-4.23,-3.33,;-1.92,.67,;-3.26,1.44,;-.59,-.1,;-1.15,2,;.39,2,;1.48,3.09,;2.57,2,;1.48,.91,;4.11,2,;4.88,3.33,;4.88,.67,;4.11,-.67,;4.88,-2,;6.42,-2,;7.19,-.67,;8.69,-.35,;8.85,1.18,;7.45,1.81,;6.42,.67,)|

BDBM489813

COC1CCN(CC1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:12.12,14.17,(-6.16,-4.67,;-6.93,-3.33,;-6.16,-2,;-6.93,-.67,;-6.16,.67,;-4.62,.67,;-3.85,-.67,;-4.62,-2,;-3.85,2,;-5.18,2.77,;-2.51,1.23,;-3.08,3.33,;-1.54,3.33,;-.45,4.42,;.64,3.33,;-.45,2.25,;2.18,3.33,;2.95,4.67,;2.95,2,;2.18,.67,;2.95,-.67,;4.49,-.67,;5.26,.67,;6.77,.99,;6.93,2.52,;5.52,3.14,;4.49,2,)|

BDBM489814

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCC3(CC3)CC2)C1)c1ncnc2[nH]ccc12 |r,wU:4.4,2.1,(3.23,4.1,;2.46,2.77,;.92,2.77,;-.17,3.86,;-1.26,2.77,;-2.8,2.77,;-3.57,1.44,;-4.9,2.21,;-2.23,.67,;-4.34,.1,;-5.88,.1,;-6.65,-1.23,;-5.88,-2.56,;-7.21,-3.33,;-5.88,-4.1,;-4.34,-2.56,;-3.57,-1.23,;-.17,1.68,;3.23,1.44,;2.46,.1,;3.23,-1.23,;4.77,-1.23,;5.54,.1,;7.05,.42,;7.21,1.95,;5.8,2.58,;4.77,1.44,)|

BDBM489815

CN(Cc1ccncc1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:15.18,13.13,(2.1,1.86,;.76,2.63,;.76,4.17,;-.57,4.94,;-.57,6.48,;-1.91,7.25,;-3.24,6.48,;-3.24,4.94,;-1.91,4.17,;-.57,1.86,;-.57,3.4,;.76,1.09,;-1.91,1.09,;-1.91,-.45,;-2.99,-1.54,;-1.91,-2.63,;-.82,-1.54,;-1.91,-4.17,;-3.24,-4.94,;-.57,-4.94,;-.57,-6.48,;.76,-7.25,;2.1,-6.48,;2.1,-4.94,;3.24,-3.91,;2.61,-2.5,;1.08,-2.66,;.76,-4.17,)|

BDBM489816

CO[C@@H]1CN(C[C@H]1F)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:6.7,12.12,14.17,wD:2.1,(-8.11,-1.51,;-6.78,-2.28,;-5.45,-1.51,;-4.97,-.05,;-3.43,-.05,;-2.96,-1.51,;-4.2,-2.42,;-4.2,-3.96,;-2.66,1.29,;-3.99,2.06,;-1.33,.52,;-1.89,2.62,;-.35,2.62,;.74,3.71,;1.83,2.62,;.74,1.53,;3.37,2.62,;4.14,3.96,;4.14,1.29,;3.37,-.05,;4.14,-1.38,;5.68,-1.38,;6.45,-.05,;7.95,.27,;8.11,1.81,;6.71,2.43,;5.68,1.29,)|

BDBM489817

C[C@@H]1COCCN1S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:11.11,13.16,1.0,(-6.93,.67,;-6.16,-.67,;-6.93,-2,;-6.16,-3.33,;-4.62,-3.33,;-3.85,-2,;-4.62,-.67,;-3.85,.67,;-5.18,1.44,;-2.51,-.1,;-3.08,2,;-1.54,2,;-.45,3.09,;.64,2,;-.45,.91,;2.18,2,;2.95,3.33,;2.95,.67,;2.18,-.67,;2.95,-2,;4.49,-2,;5.26,-.67,;6.77,-.35,;6.93,1.18,;5.52,1.81,;4.49,.67,)|

BDBM489818

CO[C@@H]1CCCN(C1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:12.12,14.17,wD:2.1,(-2.31,-4,;-3.85,-4,;-4.62,-2.67,;-6.16,-2.67,;-6.93,-1.33,;-6.16,,;-4.62,,;-3.85,-1.33,;-3.85,1.33,;-5.18,2.1,;-2.51,.56,;-3.08,2.67,;-1.54,2.67,;-.45,3.76,;.64,2.67,;-.45,1.58,;2.18,2.67,;2.95,4,;2.95,1.33,;2.18,,;2.95,-1.33,;4.49,-1.33,;5.26,,;6.77,.32,;6.93,1.85,;5.52,2.48,;4.49,1.33,)|

BDBM489819

C[C@@H]1CN([C@H](C)CO1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:12.12,14.17,wD:1.0,4.4,(-7.7,-2,;-6.16,-2,;-5.39,-.67,;-3.85,-.67,;-3.08,-2,;-1.54,-2,;-3.85,-3.33,;-5.39,-3.33,;-3.08,.67,;-4.41,1.44,;-1.74,-.1,;-2.31,2,;-.77,2,;.32,3.09,;1.41,2,;.32,.91,;2.95,2,;3.72,3.33,;3.72,.67,;2.95,-.67,;3.72,-2,;5.26,-2,;6.03,-.67,;7.54,-.35,;7.7,1.18,;6.29,1.81,;5.26,.67,)|

BDBM489820

CN(CC1CCCO1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,w:3.7,wD:14.17,12.12,(1.48,2.01,;.15,2.78,;.15,4.32,;1.48,5.09,;2.95,4.61,;3.85,5.86,;2.95,7.1,;1.48,6.63,;-1.18,2.01,;-1.18,3.55,;.15,1.24,;-2.52,1.24,;-2.52,-.3,;-3.61,-1.39,;-2.52,-2.48,;-1.43,-1.39,;-2.52,-4.02,;-3.85,-4.79,;-1.18,-4.79,;-1.18,-6.33,;.15,-7.1,;1.48,-6.33,;1.48,-4.79,;2.63,-3.76,;2,-2.35,;.47,-2.52,;.15,-4.02,)|

BDBM489821

CN([C@@H]1C[C@H](CS(=O)(=O)N(C)C2CCOC2)C1)c1ncnc2[nH]ccc12 |r,w:15.15,wD:2.1,4.4,(-3.24,-4.58,;-1.91,-3.81,;-1.91,-2.27,;-2.99,-1.18,;-1.91,-.1,;-1.91,1.44,;-.57,2.21,;-.57,3.75,;.76,1.44,;.76,2.98,;2.1,2.21,;.76,4.52,;2.01,5.43,;1.53,6.89,;-.01,6.89,;-.48,5.43,;-.82,-1.18,;-.57,-4.58,;-.57,-6.12,;.76,-6.89,;2.1,-6.12,;2.1,-4.58,;3.24,-3.55,;2.61,-2.15,;1.08,-2.31,;.76,-3.81,)|

BDBM489822

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCOCC2)C1)c1ncnc2[nH]ccc12 |r,wU:4.4,2.1,(2.95,3.33,;2.18,2,;.64,2,;-.45,3.09,;-1.54,2,;-3.08,2,;-3.85,.67,;-5.18,1.44,;-2.51,-.1,;-4.62,-.67,;-6.16,-.67,;-6.93,-2,;-6.16,-3.33,;-4.62,-3.33,;-3.85,-2,;-.45,.91,;2.95,.67,;2.18,-.67,;2.95,-2,;4.49,-2,;5.26,-.67,;6.77,-.35,;6.93,1.18,;5.52,1.81,;4.49,.67,)|

BDBM489823

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCOC3(CCCC3)C2)C1)c1ncnc2[nH]ccc12 |r,wU:4.4,2.1,(2.95,4.52,;2.18,3.19,;.64,3.19,;-.45,4.27,;-1.54,3.19,;-3.08,3.19,;-3.85,1.85,;-5.18,2.62,;-2.51,1.08,;-4.62,.52,;-6.16,.52,;-6.93,-.82,;-6.16,-2.15,;-4.62,-2.15,;-5.09,-3.61,;-3.85,-4.52,;-2.6,-3.61,;-3.08,-2.15,;-3.85,-.82,;-.45,2.1,;2.95,1.85,;2.18,.52,;2.95,-.82,;4.49,-.82,;5.26,.52,;6.77,.84,;6.93,2.37,;5.52,3,;4.49,1.85,)|

BDBM489824

CN(Cc1cnccn1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:15.18,13.13,(1.33,1.86,;,2.63,;,4.17,;1.33,4.94,;1.33,6.48,;2.67,7.25,;4,6.48,;4,4.94,;2.67,4.17,;-1.33,1.86,;-1.33,3.4,;,1.09,;-2.67,1.09,;-2.67,-.45,;-3.76,-1.54,;-2.67,-2.63,;-1.58,-1.54,;-2.67,-4.17,;-4,-4.94,;-1.33,-4.94,;-1.33,-6.48,;,-7.25,;1.33,-6.48,;1.33,-4.94,;2.48,-3.91,;1.85,-2.5,;.32,-2.66,;,-4.17,)|

BDBM489825

CCCC(C)N(C)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,w:3.3,wD:13.15,11.10,(-1.91,7.25,;-.57,6.48,;-.57,4.94,;.76,4.17,;2.1,4.94,;.76,2.63,;2.1,1.86,;-.57,1.86,;-.57,3.4,;.76,1.09,;-1.91,1.09,;-1.91,-.45,;-2.99,-1.54,;-1.91,-2.63,;-.82,-1.54,;-1.91,-4.17,;-3.24,-4.94,;-.57,-4.94,;-.57,-6.48,;.76,-7.25,;2.1,-6.48,;2.1,-4.94,;3.24,-3.91,;2.61,-2.5,;1.08,-2.66,;.76,-4.17,)|

BDBM50243842

CCCCN(C)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:12.14,10.9,(20.04,-11.87,;18.7,-12.63,;17.37,-11.86,;16.03,-12.62,;14.69,-11.84,;14.7,-10.3,;13.35,-12.61,;14.12,-13.94,;12.58,-13.93,;12.02,-11.85,;10.69,-12.62,;9.2,-12.23,;8.81,-13.72,;10.3,-14.11,;7.48,-14.5,;6.15,-13.73,;7.49,-16.04,;6.16,-16.81,;6.15,-18.35,;7.49,-19.12,;8.83,-18.34,;10.3,-18.81,;11.2,-17.56,;10.29,-16.31,;8.82,-16.8,)|

BDBM489827

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCCC3(COC3)C2)C1)c1ncnc2[nH]ccc12 |r,wU:4.4,2.1,(2.95,4.28,;2.18,2.94,;.64,2.94,;-.45,4.03,;-1.54,2.94,;-3.08,2.94,;-3.85,1.61,;-5.18,2.38,;-2.51,.84,;-4.62,.28,;-6.16,.28,;-6.93,-1.06,;-6.16,-2.39,;-4.62,-2.39,;-5.02,-3.88,;-3.53,-4.28,;-3.13,-2.79,;-3.85,-1.06,;-.45,1.85,;2.95,1.61,;2.18,.28,;2.95,-1.06,;4.49,-1.06,;5.26,.28,;6.77,.6,;6.93,2.13,;5.52,2.75,;4.49,1.61,)|

BDBM489828

CO[C@@H]1CCN(C1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:11.11,13.16,wD:2.1,(-4.2,-4.34,;-5.53,-3.57,;-5.53,-2.03,;-6.78,-1.13,;-6.3,.34,;-4.76,.34,;-4.29,-1.13,;-3.99,1.67,;-5.33,2.44,;-2.66,.9,;-3.22,3.01,;-1.68,3.01,;-.6,4.1,;.49,3.01,;-.6,1.92,;2.03,3.01,;2.8,4.34,;2.8,1.67,;2.03,.34,;2.8,-.99,;4.34,-.99,;5.11,.34,;6.62,.66,;6.78,2.19,;5.37,2.82,;4.34,1.67,)|

BDBM489829

CN(Cc1cccnc1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:15.18,13.13,(1.33,1.86,;,2.63,;,4.17,;1.33,4.94,;2.67,4.17,;4,4.94,;4,6.48,;2.67,7.25,;1.33,6.48,;-1.33,1.86,;-1.33,3.4,;,1.09,;-2.67,1.09,;-2.67,-.45,;-3.76,-1.54,;-2.67,-2.63,;-1.58,-1.54,;-2.67,-4.17,;-4,-4.94,;-1.33,-4.94,;-1.33,-6.48,;,-7.25,;1.33,-6.48,;1.33,-4.94,;2.48,-3.91,;1.85,-2.5,;.32,-2.66,;,-4.17,)|

BDBM489830

COCCOC1CCN(CC1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:15.15,17.20,(-6.93,-6.67,;-6.16,-5.33,;-6.93,-4,;-6.16,-2.67,;-6.93,-1.33,;-6.16,,;-6.93,1.33,;-6.16,2.67,;-4.62,2.67,;-3.85,1.33,;-4.62,,;-3.85,4,;-5.18,4.77,;-2.51,3.23,;-3.08,5.33,;-1.54,5.33,;-.45,6.42,;.64,5.33,;-.45,4.25,;2.18,5.33,;2.95,6.67,;2.95,4,;2.18,2.67,;2.95,1.33,;4.49,1.33,;5.26,2.67,;6.77,2.99,;6.93,4.52,;5.52,5.15,;4.49,4,)|

BDBM489831

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCC3(C2)CCOCC3)C1)c1ncnc2[nH]ccc12 |r,wU:4.4,2.1,(4.14,3.89,;3.37,2.55,;1.83,2.55,;.74,3.64,;-.35,2.55,;-1.89,2.55,;-2.66,1.22,;-3.99,1.99,;-1.33,.45,;-3.43,-.11,;-2.96,-1.58,;-4.2,-2.48,;-5.45,-1.58,;-4.97,-.11,;-6.78,-.81,;-8.11,-1.58,;-8.11,-3.12,;-6.78,-3.89,;-5.45,-3.12,;.74,1.47,;4.14,1.22,;3.37,-.11,;4.14,-1.45,;5.68,-1.45,;6.45,-.11,;7.95,.21,;8.11,1.74,;6.71,2.36,;5.68,1.22,)|

BDBM489832

COCCN(C)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:12.14,10.9,(-1.91,7.25,;-.57,6.48,;-.57,4.94,;.76,4.17,;.76,2.63,;2.1,1.86,;-.57,1.86,;-.57,3.4,;.76,1.09,;-1.91,1.09,;-1.91,-.45,;-2.99,-1.54,;-1.91,-2.63,;-.82,-1.54,;-1.91,-4.17,;-3.24,-4.94,;-.57,-4.94,;-.57,-6.48,;.76,-7.25,;2.1,-6.48,;2.1,-4.94,;3.24,-3.91,;2.61,-2.5,;1.08,-2.66,;.76,-4.17,)|

BDBM489833

CCOCC1(F)CCN(CC1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:15.15,17.20,(-8.43,-5.22,;-8.03,-3.73,;-6.54,-3.33,;-6.14,-1.85,;-4.66,-1.45,;-4.26,-2.94,;-5.43,-.11,;-4.66,1.22,;-3.12,1.22,;-2.35,-.11,;-3.12,-1.45,;-2.35,2.55,;-3.68,3.32,;-1.01,1.78,;-1.58,3.89,;-.04,3.89,;1.05,4.98,;2.14,3.89,;1.05,2.8,;3.68,3.89,;4.45,5.22,;4.45,2.55,;3.68,1.22,;4.45,-.11,;5.99,-.11,;6.76,1.22,;8.27,1.54,;8.43,3.07,;7.02,3.7,;5.99,2.55,)|

BDBM489834

CC1CCCN(C1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,w:1.0,wU:11.11,13.16,(-3.85,-4,;-4.62,-2.67,;-6.16,-2.67,;-6.93,-1.33,;-6.16,,;-4.62,,;-3.85,-1.33,;-3.85,1.33,;-5.18,2.1,;-2.51,.56,;-3.08,2.67,;-1.54,2.67,;-.45,3.76,;.64,2.67,;-.45,1.58,;2.18,2.67,;2.95,4,;2.95,1.33,;2.18,,;2.95,-1.33,;4.49,-1.33,;5.26,,;6.77,.32,;6.93,1.85,;5.52,2.48,;4.49,1.33,)|

BDBM489835

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCC(CC2)C(F)(F)F)C1)c1ncnc2[nH]ccc12 |r,wU:4.4,2.1,(3.62,4.67,;2.85,3.33,;1.31,3.33,;.22,4.42,;-.87,3.33,;-2.41,3.33,;-3.18,2,;-4.51,2.77,;-1.85,1.23,;-3.95,.67,;-5.49,.67,;-6.26,-.67,;-5.49,-2,;-3.95,-2,;-3.18,-.67,;-6.26,-3.33,;-7.03,-4.67,;-4.93,-4.1,;-7.59,-2.56,;.22,2.25,;3.62,2,;2.85,.67,;3.62,-.67,;5.16,-.67,;5.93,.67,;7.43,.99,;7.59,2.52,;6.19,3.14,;5.16,2,)|

BDBM489836

CCN(C)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:10.12,8.7,(2.1,6.09,;.76,5.32,;.76,3.78,;2.1,3.01,;-.57,3.01,;-.57,4.55,;.76,2.24,;-1.91,2.24,;-1.91,.7,;-2.99,-.38,;-1.91,-1.47,;-.82,-.38,;-1.91,-3.01,;-3.24,-3.78,;-.57,-3.78,;-.57,-5.32,;.76,-6.09,;2.1,-5.32,;2.1,-3.78,;3.24,-2.75,;2.61,-1.35,;1.08,-1.51,;.76,-3.01,)|

BDBM489837

CN([C@@H]1C[C@H](CS(=O)(=O)N2CC[C@H](F)C2)C1)c1ncnc2[nH]ccc12 |r,wU:12.12,4.4,2.1,(2.8,3.96,;2.03,2.62,;.49,2.62,;-.6,3.71,;-1.68,2.62,;-3.22,2.62,;-3.99,1.29,;-5.33,2.06,;-2.66,.52,;-4.76,-.05,;-6.3,-.05,;-6.78,-1.51,;-5.53,-2.42,;-5.53,-3.96,;-4.29,-1.51,;-.6,1.53,;2.8,1.29,;2.03,-.05,;2.8,-1.38,;4.34,-1.38,;5.11,-.05,;6.62,.27,;6.78,1.81,;5.37,2.43,;4.34,1.29,)|

BDBM489838

C[C@H]1CN(CCO1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:1.0,11.11,13.16,(-7.7,-2,;-6.16,-2,;-5.39,-.67,;-3.85,-.67,;-3.08,-2,;-3.85,-3.33,;-5.39,-3.33,;-3.08,.67,;-4.41,1.44,;-1.74,-.1,;-2.31,2,;-.77,2,;.32,3.09,;1.41,2,;.32,.91,;2.95,2,;3.72,3.33,;3.72,.67,;2.95,-.67,;3.72,-2,;5.26,-2,;6.03,-.67,;7.54,-.35,;7.7,1.18,;6.29,1.81,;5.26,.67,)|

BDBM489839

CC1CCCCN1S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,w:1.0,wU:11.11,13.16,(-2.31,-2,;-3.85,-2,;-4.62,-3.33,;-6.16,-3.33,;-6.93,-2,;-6.16,-.67,;-4.62,-.67,;-3.85,.67,;-5.18,1.44,;-2.51,-.1,;-3.08,2,;-1.54,2,;-.45,3.09,;.64,2,;-.45,.91,;2.18,2,;2.95,3.33,;2.95,.67,;2.18,-.67,;2.95,-2,;4.49,-2,;5.26,-.67,;6.77,-.35,;6.93,1.18,;5.52,1.81,;4.49,.67,)|

BDBM489840

CO[C@H]1C[C@@H]2CC[C@H](C1)N2S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:14.15,16.20,7.9,2.1,wD:4.10,TLB:1:2:5.6:9,(-3.79,-6.04,;-4.88,-4.95,;-4.48,-3.47,;-5.03,-1.73,;-5.89,-.45,;-7.38,-.1,;-6.05,.67,;-4.55,.37,;-3.74,-.94,;-4.16,2.04,;-3.39,3.37,;-4.73,4.14,;-2.06,2.6,;-2.62,4.71,;-1.08,4.71,;.01,5.8,;1.09,4.71,;.01,3.62,;2.63,4.71,;3.4,6.04,;3.4,3.37,;2.63,2.04,;3.4,.71,;4.94,.71,;5.71,2.04,;7.22,2.36,;7.38,3.89,;5.98,4.52,;4.94,3.37,)|

BDBM489841

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCCCC2)C1)c1ncnc2[nH]ccc12 |r,wU:4.4,2.1,(2.95,3.33,;2.18,2,;.64,2,;-.45,3.09,;-1.54,2,;-3.08,2,;-3.85,.67,;-5.18,1.44,;-2.51,-.1,;-4.62,-.67,;-6.16,-.67,;-6.93,-2,;-6.16,-3.33,;-4.62,-3.33,;-3.85,-2,;-.45,.91,;2.95,.67,;2.18,-.67,;2.95,-2,;4.49,-2,;5.26,-.67,;6.77,-.35,;6.93,1.18,;5.52,1.81,;4.49,.67,)|

BDBM489842

CN([C@@H]1C[C@H](CS(=O)(=O)N2CC[C@@H](F)C2)C1)c1ncnc2[nH]ccc12 |r,wU:4.4,2.1,wD:12.12,(2.8,3.96,;2.03,2.62,;.49,2.62,;-.6,3.71,;-1.68,2.62,;-3.22,2.62,;-3.99,1.29,;-5.33,2.06,;-2.66,.52,;-4.76,-.05,;-6.3,-.05,;-6.78,-1.51,;-5.53,-2.42,;-5.53,-3.96,;-4.29,-1.51,;-.6,1.53,;2.8,1.29,;2.03,-.05,;2.8,-1.38,;4.34,-1.38,;5.11,-.05,;6.62,.27,;6.78,1.81,;5.37,2.43,;4.34,1.29,)|

BDBM489843

C[C@@H]1CCCN1S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:10.10,12.15,wD:1.0,(-2.96,-3.05,;-4.29,-2.28,;-5.53,-3.19,;-6.78,-2.28,;-6.3,-.82,;-4.76,-.82,;-3.99,.52,;-5.33,1.29,;-2.66,-.25,;-3.22,1.85,;-1.68,1.85,;-.6,2.94,;.49,1.85,;-.6,.76,;2.03,1.85,;2.8,3.19,;2.8,.52,;2.03,-.82,;2.8,-2.15,;4.34,-2.15,;5.11,-.82,;6.62,-.5,;6.78,1.04,;5.37,1.66,;4.34,.52,)|

BDBM489844

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCC(F)C2)C1)c1ncnc2[nH]ccc12 |r,w:12.12,wU:4.4,2.1,(2.8,3.96,;2.03,2.62,;.49,2.62,;-.6,3.71,;-1.68,2.62,;-3.22,2.62,;-3.99,1.29,;-5.33,2.06,;-2.66,.52,;-4.76,-.05,;-6.3,-.05,;-6.78,-1.51,;-5.53,-2.42,;-5.53,-3.96,;-4.29,-1.51,;-.6,1.53,;2.8,1.29,;2.03,-.05,;2.8,-1.38,;4.34,-1.38,;5.11,-.05,;6.62,.27,;6.78,1.81,;5.37,2.43,;4.34,1.29,)|

BDBM489845

CN([C@@H]1C[C@H](CS(=O)(=O)N(C)C2CCC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-3.24,-4.49,;-1.91,-3.72,;-1.91,-2.18,;-2.99,-1.09,;-1.91,,;-1.91,1.54,;-.57,2.31,;-.57,3.85,;.76,1.54,;.76,3.08,;2.1,2.31,;.76,4.62,;1.85,5.71,;.76,6.8,;-.33,5.71,;-.82,-1.09,;-.57,-4.49,;-.57,-6.03,;.76,-6.8,;2.1,-6.03,;2.1,-4.49,;3.24,-3.46,;2.61,-2.05,;1.08,-2.21,;.76,-3.72,)|

BDBM489846

C[C@@H]1OCC[C@@H]1N(C)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:5.6,1.0,wD:14.17,12.12,(3.29,4.66,;1.96,5.43,;1.48,6.89,;-.06,6.89,;-.54,5.43,;.71,4.52,;.71,2.98,;2.04,2.21,;-.62,2.21,;-.62,3.75,;.71,1.44,;-1.96,1.44,;-1.96,-.1,;-3.05,-1.18,;-1.96,-2.27,;-.87,-1.18,;-1.96,-3.81,;-3.29,-4.58,;-.62,-4.58,;-.62,-6.12,;.71,-6.89,;2.04,-6.12,;2.04,-4.58,;3.19,-3.55,;2.56,-2.15,;1.03,-2.31,;.71,-3.81,)|

BDBM489847

C[C@H]1CN(C[C@@H](C)O1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:1.0,12.12,14.17,5.5,(-7.7,-1.33,;-6.16,-1.33,;-5.39,,;-3.85,,;-3.08,-1.33,;-3.85,-2.67,;-3.08,-4,;-5.39,-2.67,;-3.08,1.33,;-4.41,2.1,;-1.74,.56,;-2.31,2.67,;-.77,2.67,;.32,3.76,;1.41,2.67,;.32,1.58,;2.95,2.67,;3.72,4,;3.72,1.33,;2.95,,;3.72,-1.33,;5.26,-1.33,;6.03,,;7.54,.32,;7.7,1.85,;6.29,2.48,;5.26,1.33,)|

BDBM489848

COCC1CCCN(C1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,w:3.2,wU:13.13,15.18,(-1.54,-4.67,;-2.31,-3.33,;-3.85,-3.33,;-4.62,-2,;-6.16,-2,;-6.93,-.67,;-6.16,.67,;-4.62,.67,;-3.85,-.67,;-3.85,2,;-5.18,2.77,;-2.51,1.23,;-3.08,3.33,;-1.54,3.33,;-.45,4.42,;.64,3.33,;-.45,2.25,;2.18,3.33,;2.95,4.67,;2.95,2,;2.18,.67,;2.95,-.67,;4.49,-.67,;5.26,.67,;6.77,.99,;6.93,2.52,;5.52,3.14,;4.49,2,)|

BDBM489849

COC1CCCN(C1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,w:2.1,wU:12.12,14.17,(-2.31,-4,;-3.85,-4,;-4.62,-2.67,;-6.16,-2.67,;-6.93,-1.33,;-6.16,,;-4.62,,;-3.85,-1.33,;-3.85,1.33,;-5.18,2.1,;-2.51,.56,;-3.08,2.67,;-1.54,2.67,;-.45,3.76,;.64,2.67,;-.45,1.58,;2.18,2.67,;2.95,4,;2.95,1.33,;2.18,,;2.95,-1.33,;4.49,-1.33,;5.26,,;6.77,.32,;6.93,1.85,;5.52,2.48,;4.49,1.33,)|

BDBM489850

CCC1CN(CCO1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,w:2.1,wU:12.12,14.17,(-8.08,-3.33,;-7.31,-2,;-5.77,-2,;-5,-.67,;-3.46,-.67,;-2.69,-2,;-3.46,-3.33,;-5,-3.33,;-2.69,.67,;-4.03,1.44,;-1.36,-.1,;-1.92,2,;-.38,2,;.71,3.09,;1.8,2,;.71,.91,;3.34,2,;4.11,3.33,;4.11,.67,;3.34,-.67,;4.11,-2,;5.65,-2,;6.42,-.67,;7.92,-.35,;8.08,1.18,;6.68,1.81,;5.65,.67,)|

BDBM489851

CN([C@@H]1C[C@H](CS(=O)(=O)N(C)C2CCCOC2)C1)c1ncnc2[nH]ccc12 |r,w:16.16,wD:2.1,4.4,(-3.24,-4.94,;-1.91,-4.17,;-1.91,-2.63,;-2.99,-1.54,;-1.91,-.45,;-1.91,1.09,;-.57,1.86,;-.57,3.4,;.76,1.09,;.76,2.63,;2.1,1.86,;.76,4.17,;2.1,4.94,;2.1,6.48,;.76,7.25,;-.57,6.48,;-.57,4.94,;-.82,-1.54,;-.57,-4.94,;-.57,-6.48,;.76,-7.25,;2.1,-6.48,;2.1,-4.94,;3.24,-3.91,;2.61,-2.5,;1.08,-2.66,;.76,-4.17,)|

BDBM489852

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCC(C2)C(F)(F)F)C1)c1ncnc2[nH]ccc12 |r,w:12.14,wD:2.1,4.4,(-5.43,-.96,;-4.1,-1.73,;-2.76,-.96,;-2.37,.53,;-.88,.13,;.45,.9,;1.79,.13,;1.02,-1.2,;2.56,-1.2,;3.12,.9,;4.66,.9,;5.14,2.36,;3.89,3.27,;2.65,2.36,;3.89,4.81,;3.89,6.35,;2.35,4.81,;5.43,4.81,;-1.28,-1.36,;-4.1,-3.27,;-5.43,-4.04,;-5.43,-5.58,;-4.1,-6.35,;-2.76,-5.58,;-1.3,-6.06,;-.39,-4.81,;-1.3,-3.56,;-2.76,-4.04,)|

BDBM489853

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCC(C2)C(F)F)C1)c1ncnc2[nH]ccc12 |r,w:12.14,wD:2.1,4.4,(-6.44,.37,;-5.11,-.4,;-3.77,.37,;-3.37,1.85,;-1.89,1.46,;-.55,2.23,;.78,1.46,;.01,.12,;1.55,.12,;2.11,2.23,;1.64,3.69,;2.88,4.6,;4.13,3.69,;3.65,2.23,;5.67,3.69,;6.44,5.02,;6.44,2.36,;-2.29,-.03,;-5.11,-1.94,;-6.44,-2.71,;-6.44,-4.25,;-5.11,-5.02,;-3.77,-4.25,;-2.31,-4.73,;-1.4,-3.48,;-2.31,-2.24,;-3.77,-2.71,)|

BDBM489854

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCC(F)(F)C2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.29,-.09,;-3.95,-.86,;-2.62,-.09,;-2.22,1.4,;-.73,1,;.6,1.77,;1.94,1,;1.17,-.33,;2.71,-.33,;3.27,1.77,;4.81,1.77,;5.29,3.24,;4.04,4.14,;3.27,5.48,;4.81,5.48,;2.79,3.24,;-1.13,-.48,;-3.95,-2.4,;-5.29,-3.17,;-5.29,-4.71,;-3.95,-5.48,;-2.62,-4.71,;-1.15,-5.18,;-.25,-3.94,;-1.15,-2.69,;-2.62,-3.17,)|

BDBM489855

CN([C@@H]1C[C@H](CS(=O)(=O)N2CC(Cl)C2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.89,.84,;-4.55,.07,;-3.22,.84,;-2.82,2.32,;-1.33,1.93,;,2.69,;1.33,1.93,;.56,.59,;2.1,.59,;2.67,2.69,;4.15,2.3,;4.55,3.78,;5.89,4.55,;3.07,4.18,;-1.73,.44,;-4.55,-1.47,;-5.89,-2.24,;-5.89,-3.78,;-4.55,-4.55,;-3.22,-3.78,;-1.76,-4.26,;-.85,-3.01,;-1.76,-1.77,;-3.22,-2.24,)|

BDBM489856

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCN(C)CC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.79,-.03,;-4.45,-.8,;-3.12,-.03,;-2.72,1.46,;-1.23,1.06,;.1,1.83,;1.43,1.06,;.66,-.27,;2.2,-.27,;2.52,2.15,;4.01,1.75,;5.1,2.84,;4.7,4.33,;5.79,5.42,;3.21,4.73,;2.12,3.64,;-1.63,-.43,;-4.45,-2.34,;-5.79,-3.11,;-5.79,-4.65,;-4.45,-5.42,;-3.12,-4.65,;-1.66,-5.12,;-.75,-3.88,;-1.66,-2.63,;-3.12,-3.11,)|

BDBM489857

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCN(CC2)C(C)=O)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.53,-.77,;-5.2,-1.54,;-3.86,-.77,;-3.47,.72,;-1.98,.32,;-.64,1.09,;.69,.32,;-.08,-1.02,;1.46,-1.02,;1.78,1.41,;3.27,1.01,;4.35,2.1,;3.96,3.58,;2.47,3.98,;1.38,2.89,;5.04,4.67,;6.53,4.28,;4.65,6.16,;-2.38,-1.17,;-5.2,-3.08,;-6.53,-3.85,;-6.53,-5.39,;-5.2,-6.16,;-3.86,-5.39,;-2.4,-5.87,;-1.49,-4.62,;-2.4,-3.38,;-3.86,-3.85,)|

BDBM489858

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCN(CC2)C(=O)C2CC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-7.28,-.77,;-5.94,-1.54,;-4.61,-.77,;-4.21,.72,;-2.72,.32,;-1.39,1.09,;-.06,.32,;-.83,-1.02,;.71,-1.02,;1.03,1.41,;2.52,1.01,;3.61,2.1,;3.21,3.58,;1.72,3.98,;.64,2.89,;4.3,4.67,;3.9,6.16,;5.79,4.28,;6.88,3.19,;7.28,4.67,;-3.12,-1.17,;-5.94,-3.08,;-7.28,-3.85,;-7.28,-5.39,;-5.94,-6.16,;-4.61,-5.39,;-3.14,-5.87,;-2.24,-4.62,;-3.14,-3.38,;-4.61,-3.85,)|

BDBM489859

CN([C@@H]1C[C@H](CS(=O)(=O)N2CC3(COC3)C2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-4.28,1.38,;-2.94,.61,;-1.61,1.38,;-1.21,2.87,;.28,2.47,;1.61,3.24,;2.94,2.47,;4.28,3.24,;2.94,4.01,;2.94,.93,;1.85,-.16,;2.94,-1.25,;1.85,-2.34,;2.94,-3.43,;4.03,-2.34,;4.03,-.16,;-.12,.98,;-2.94,-.93,;-4.28,-1.7,;-4.28,-3.24,;-2.94,-4.01,;-1.61,-3.24,;-.15,-3.72,;.76,-2.47,;-.15,-1.22,;-1.61,-1.7,)|

BDBM489860

CC1CN(C1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:11.14,9.9,(2.94,-2.79,;2.94,-1.25,;1.85,-.16,;2.94,.93,;4.03,-.16,;2.94,2.47,;4.28,3.24,;2.94,4.01,;1.61,3.24,;.28,2.47,;-1.21,2.87,;-1.61,1.38,;-.12,.98,;-2.94,.61,;-4.28,1.38,;-2.94,-.93,;-4.28,-1.7,;-4.28,-3.24,;-2.94,-4.01,;-1.61,-3.24,;-.15,-3.72,;.76,-2.47,;-.15,-1.22,;-1.61,-1.7,)|

BDBM489861

COC1(C)CN(C1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:13.16,11.11,(1.61,-3.56,;2.94,-2.79,;2.94,-1.25,;4.28,-2.02,;1.85,-.16,;2.94,.93,;4.03,-.16,;2.94,2.47,;4.28,3.24,;2.94,4.01,;1.61,3.24,;.28,2.47,;-1.21,2.87,;-1.61,1.38,;-.12,.98,;-2.94,.61,;-4.28,1.38,;-2.94,-.93,;-4.28,-1.7,;-4.28,-3.24,;-2.94,-4.01,;-1.61,-3.24,;-.15,-3.72,;.76,-2.47,;-.15,-1.22,;-1.61,-1.7,)|

BDBM489862

CN([C@@H]1C[C@H](CS(=O)(=O)N2CC(C)(O)C2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-4.28,1.38,;-2.94,.61,;-1.61,1.38,;-1.21,2.87,;.28,2.47,;1.61,3.24,;2.94,2.47,;4.28,3.24,;2.94,4.01,;2.94,.93,;1.85,-.16,;2.94,-1.25,;2.94,-2.79,;4.28,-2.02,;4.03,-.16,;-.12,.98,;-2.94,-.93,;-4.28,-1.7,;-4.28,-3.24,;-2.94,-4.01,;-1.61,-3.24,;-.15,-3.72,;.76,-2.47,;-.15,-1.22,;-1.61,-1.7,)|

BDBM489863

COC1CN(C1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:12.15,10.10,(1.61,-3.56,;2.94,-2.79,;2.94,-1.25,;1.85,-.16,;2.94,.93,;4.03,-.16,;2.94,2.47,;4.28,3.24,;2.94,4.01,;1.61,3.24,;.28,2.47,;-1.21,2.87,;-1.61,1.38,;-.12,.98,;-2.94,.61,;-4.28,1.38,;-2.94,-.93,;-4.28,-1.7,;-4.28,-3.24,;-2.94,-4.01,;-1.61,-3.24,;-.15,-3.72,;.76,-2.47,;-.15,-1.22,;-1.61,-1.7,)|

BDBM489864

CN([C@@H]1C[C@H](CS(=O)(=O)N2CC(F)C2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-4.28,1.38,;-2.94,.61,;-1.61,1.38,;-1.21,2.87,;.28,2.47,;1.61,3.24,;2.94,2.47,;4.28,3.24,;2.94,4.01,;2.94,.93,;1.85,-.16,;2.94,-1.25,;2.94,-2.79,;4.03,-.16,;-.12,.98,;-2.94,-.93,;-4.28,-1.7,;-4.28,-3.24,;-2.94,-4.01,;-1.61,-3.24,;-.15,-3.72,;.76,-2.47,;-.15,-1.22,;-1.61,-1.7,)|

BDBM489865

CN([C@@H]1C[C@H](CS(=O)(=O)N2CC3(CCO3)C2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-4.28,1.38,;-2.94,.61,;-1.61,1.38,;-1.21,2.87,;.28,2.47,;1.61,3.24,;2.94,2.47,;4.28,3.24,;2.94,4.01,;2.94,.93,;1.85,-.16,;2.94,-1.25,;1.85,-2.34,;2.94,-3.43,;4.03,-2.34,;4.03,-.16,;-.12,.98,;-2.94,-.93,;-4.28,-1.7,;-4.28,-3.24,;-2.94,-4.01,;-1.61,-3.24,;-.15,-3.72,;.76,-2.47,;-.15,-1.22,;-1.61,-1.7,)|

BDBM489866

COCC1CCN(CC1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:13.13,15.18,(-6.93,-5.33,;-6.16,-4,;-6.93,-2.67,;-6.16,-1.33,;-6.93,,;-6.16,1.33,;-4.62,1.33,;-3.85,,;-4.62,-1.33,;-3.85,2.67,;-5.18,3.44,;-2.51,1.9,;-3.08,4,;-1.54,4,;-.45,5.09,;.64,4,;-.45,2.91,;2.18,4,;2.95,5.33,;2.95,2.67,;2.18,1.33,;2.95,,;4.49,,;5.26,1.33,;6.77,1.65,;6.93,3.19,;5.52,3.81,;4.49,2.67,)|

BDBM489867

CN(CC(F)(F)F)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:13.15,11.10,(2.1,2.35,;.76,3.12,;.76,4.66,;-.57,5.43,;-1.91,6.2,;.2,6.76,;-1.34,4.09,;-.57,2.35,;-.57,3.89,;.76,1.58,;-1.91,1.58,;-1.91,.04,;-2.99,-1.05,;-1.91,-2.14,;-.82,-1.05,;-1.91,-3.68,;-3.24,-4.45,;-.57,-4.45,;-.57,-5.99,;.76,-6.76,;2.1,-5.99,;2.1,-4.45,;3.24,-3.42,;2.61,-2.01,;1.08,-2.17,;.76,-3.68,)|

BDBM489868

CN([C@@H]1C[C@H](CS(=O)(=O)N2CC(CC(F)F)C2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-4.94,1.93,;-3.61,1.15,;-2.28,1.93,;-1.88,3.41,;-.39,3.01,;.94,3.78,;2.28,3.01,;3.61,3.78,;2.28,4.55,;2.28,1.47,;1.19,.38,;2.28,-.7,;2.28,-2.24,;3.61,-3.01,;3.61,-4.55,;4.94,-2.24,;3.37,.38,;-.79,1.53,;-3.61,-.38,;-4.94,-1.15,;-4.94,-2.69,;-3.61,-3.47,;-2.28,-2.69,;-.81,-3.17,;.09,-1.93,;-.81,-.68,;-2.28,-1.15,)|

BDBM489869

CN([C@@H]1C[C@H](CS(=O)(=O)N2CC(F)(F)C2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.85,.84,;-4.52,.07,;-3.19,.84,;-3.19,2.38,;-1.65,2.38,;-.56,3.47,;.93,3.07,;1.33,4.55,;.53,1.58,;2.42,2.67,;3.19,1.33,;4.52,2.1,;5.85,2.87,;5.29,.77,;3.75,3.44,;-1.65,.84,;-4.52,-1.47,;-5.85,-2.24,;-5.85,-3.78,;-4.52,-4.55,;-3.19,-3.78,;-1.72,-4.26,;-.82,-3.01,;-1.72,-1.77,;-3.19,-2.24,)|

BDBM489870

CN([C@@H]1C[C@H](CS(=O)(=O)N2CC(C2)C(F)(F)F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-4.28,1.51,;-2.94,.74,;-1.61,1.51,;-1.21,3,;.28,2.6,;1.61,3.37,;2.94,2.6,;4.28,3.37,;2.94,4.14,;2.94,1.06,;1.85,-.03,;2.94,-1.12,;4.03,-.03,;2.94,-2.66,;1.61,-3.43,;3.34,-4.14,;4.28,-3.43,;-.12,1.12,;-2.94,-.8,;-4.28,-1.57,;-4.28,-3.11,;-2.94,-3.88,;-1.61,-3.11,;-.15,-3.58,;.76,-2.34,;-.15,-1.09,;-1.61,-1.57,)|

BDBM489871

CN([C@@H]1C[C@H](CS(=O)(=O)N2CC(C2)OC(F)F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-4.94,1.93,;-3.61,1.16,;-2.28,1.93,;-1.88,3.41,;-.39,3.01,;.94,3.78,;2.28,3.01,;2.28,4.55,;3.61,3.78,;2.28,1.47,;1.19,.38,;2.28,-.7,;3.37,.38,;2.28,-2.24,;3.61,-3.01,;3.61,-4.55,;4.94,-2.24,;-.79,1.53,;-3.61,-.38,;-4.94,-1.15,;-4.94,-2.69,;-3.61,-3.46,;-2.28,-2.69,;-.81,-3.17,;.09,-1.92,;-.81,-.68,;-2.28,-1.15,)|

BDBM489872

CN([C@@H]1C[C@H](CS(=O)(=O)C2CCC(C2)C#N)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.23,-.44,;-4.9,-1.21,;-3.81,-.12,;-3.81,1.42,;-2.27,1.42,;-1.18,2.51,;.31,2.11,;-.46,.77,;1.08,.77,;1.4,3.2,;.92,4.66,;2.17,5.57,;3.41,4.66,;2.94,3.2,;4.9,5.06,;6.23,5.83,;-2.27,-.12,;-4.9,-2.75,;-6.23,-3.52,;-6.23,-5.06,;-4.9,-5.83,;-3.57,-5.06,;-2.1,-5.54,;-1.2,-4.29,;-2.1,-3.04,;-3.57,-3.52,)|

BDBM489873

CN([C@@H]1C[C@H](CS(=O)(=O)CC2CC(C)(C2)C#N)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.76,.33,;-5.43,-.44,;-4.34,.65,;-4.34,2.19,;-2.8,2.19,;-1.71,3.28,;-.22,2.88,;-.99,1.55,;.55,1.55,;.87,3.97,;2.41,3.97,;3.5,2.88,;4.58,3.97,;5.67,5.06,;3.5,5.06,;5.67,2.88,;6.76,1.79,;-2.8,.65,;-5.43,-1.98,;-6.76,-2.75,;-6.76,-4.29,;-5.43,-5.06,;-4.09,-4.29,;-2.63,-4.76,;-1.72,-3.52,;-2.63,-2.27,;-4.09,-2.75,)|

BDBM489874

CN([C@@H]1C[C@H](CS(=O)(=O)C2CC(C2)C(F)F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.35,-1.52,;-4.02,-2.29,;-2.93,-1.2,;-2.93,.34,;-1.39,.34,;-.3,1.42,;1.19,1.03,;.42,-.31,;1.96,-.31,;1.96,2.36,;3.44,2.76,;3.04,4.25,;1.56,3.85,;3.81,5.58,;3.04,6.91,;5.35,5.58,;-1.39,-1.2,;-4.02,-3.83,;-5.35,-4.6,;-5.35,-6.14,;-4.02,-6.91,;-2.69,-6.14,;-1.22,-6.62,;-.32,-5.37,;-1.22,-4.13,;-2.69,-4.6,)|

BDBM489875

CC(C)C(=O)N1CC(C1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:15.18,13.13,(6.76,5.05,;5.67,3.96,;6.07,2.47,;4.18,4.35,;3.78,5.84,;3.09,3.27,;3.09,1.73,;1.55,1.73,;1.55,3.27,;.46,.64,;-.63,-.45,;.86,-.85,;-.87,1.41,;-2.2,.64,;-3.69,1.04,;-4.09,-.45,;-2.6,-.85,;-5.42,-1.22,;-6.76,-.45,;-5.42,-2.76,;-6.76,-3.53,;-6.76,-5.07,;-5.42,-5.84,;-4.09,-5.07,;-2.63,-5.55,;-1.72,-4.3,;-2.63,-3.06,;-4.09,-3.53,)|

BDBM489876

CN([C@@H]1C[C@H](CS(=O)(=O)C2CN(C2)C(=O)C2CC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.96,-.45,;-5.62,-1.22,;-4.29,-.45,;-3.89,1.04,;-2.4,.64,;-1.07,1.41,;.26,.64,;-.83,-.45,;.66,-.85,;1.35,1.73,;2.89,1.73,;2.89,3.27,;1.35,3.27,;3.98,4.35,;3.58,5.84,;5.47,3.96,;6.56,2.87,;6.96,4.35,;-2.8,-.85,;-5.62,-2.76,;-6.96,-3.53,;-6.96,-5.07,;-5.62,-5.84,;-4.29,-5.07,;-2.82,-5.55,;-1.92,-4.3,;-2.82,-3.06,;-4.29,-3.53,)|

BDBM489877

CN([C@@H]1C[C@H](CS(=O)(=O)C2CN(C2)C(C)=O)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.21,-.45,;-4.88,-1.22,;-3.55,-.45,;-3.15,1.04,;-1.66,.64,;-.33,1.41,;1.01,.64,;-.08,-.45,;1.41,-.85,;2.1,1.73,;3.64,1.73,;3.64,3.27,;2.1,3.27,;4.73,4.35,;6.21,3.96,;4.33,5.84,;-2.06,-.85,;-4.88,-2.76,;-6.21,-3.53,;-6.21,-5.07,;-4.88,-5.84,;-3.55,-5.07,;-2.08,-5.55,;-1.18,-4.3,;-2.08,-3.06,;-3.55,-3.53,)|

BDBM489878

CN([C@@H]1C[C@H](CS(=O)(=O)C2CN(CC3CC3)C2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.96,.29,;-5.62,-.48,;-4.29,.29,;-3.89,1.78,;-2.4,1.38,;-1.07,2.15,;.26,1.38,;-.83,.29,;.66,-.11,;1.35,2.47,;2.89,2.47,;2.89,4.01,;3.98,5.1,;5.47,4.7,;6.56,3.61,;6.96,5.1,;1.35,4.01,;-2.8,-.11,;-5.62,-2.02,;-6.96,-2.79,;-6.96,-4.33,;-5.62,-5.1,;-4.29,-4.33,;-2.82,-4.8,;-1.92,-3.56,;-2.82,-2.31,;-4.29,-2.79,)|

BDBM489879

CN([C@@H]1C[C@H](CS(=O)(=O)C2CN(CC(F)F)C2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.76,-.05,;-5.42,-.82,;-4.09,-.05,;-3.69,1.43,;-2.2,1.04,;-.87,1.81,;.46,1.04,;-.63,-.05,;.86,-.45,;1.55,2.12,;3.09,2.12,;3.09,3.66,;4.18,4.75,;5.67,4.35,;6.76,5.44,;6.07,2.87,;1.55,3.66,;-2.6,-.45,;-5.42,-2.36,;-6.76,-3.13,;-6.76,-4.67,;-5.42,-5.44,;-4.09,-4.67,;-2.63,-5.15,;-1.72,-3.9,;-2.63,-2.66,;-4.09,-3.13,)|

BDBM489880

CN([C@@H]1C[C@H](CS(=O)(=O)C2CN(C2)C2CC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-3.71,-2.3,;-2.38,-3.07,;-1.05,-2.3,;-.65,-.81,;.84,-1.21,;2.17,-.44,;2.17,1.1,;.63,1.1,;3.71,1.1,;2.17,2.64,;3.26,3.73,;2.17,4.82,;1.08,3.73,;2.17,6.36,;2.94,7.69,;1.4,7.69,;.44,-2.7,;-2.38,-4.61,;-3.71,-5.38,;-3.71,-6.92,;-2.38,-7.69,;-1.05,-6.92,;.42,-7.4,;1.32,-6.15,;.42,-4.9,;-1.05,-5.38,)|

BDBM489882

CN([C@@H]1C[C@H](CS(=O)(=O)C2CN(CC(F)(F)F)C2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.76,-.05,;-5.42,-.82,;-4.09,-.05,;-3.69,1.43,;-2.2,1.04,;-.87,1.81,;.46,1.04,;-.63,-.05,;.86,-.45,;1.55,2.12,;3.09,2.12,;3.09,3.66,;4.18,4.75,;5.67,4.35,;6.76,5.44,;6.07,2.87,;4.9,3.02,;1.55,3.66,;-2.6,-.45,;-5.42,-2.36,;-6.76,-3.13,;-6.76,-4.67,;-5.42,-5.44,;-4.09,-4.67,;-2.63,-5.15,;-1.72,-3.9,;-2.63,-2.66,;-4.09,-3.13,)|

BDBM489883

CN([C@@H]1C[C@H](CS(=O)(=O)[C@H]2CC[C@H](C2)C#N)C1)c1ncnc2[nH]ccc12 |r,wU:9.8,12.14,wD:2.1,4.4,(-6.31,-.31,;-4.98,-1.08,;-3.89,.01,;-3.89,1.55,;-2.35,1.55,;-1.26,2.64,;.23,2.24,;-.54,.91,;1.32,1.15,;1.32,3.33,;.84,4.79,;2.09,5.7,;3.33,4.79,;2.86,3.33,;4.82,5.19,;6.31,5.59,;-2.35,.01,;-4.98,-2.62,;-6.31,-3.39,;-6.31,-4.93,;-4.98,-5.7,;-3.64,-4.93,;-2.18,-5.4,;-1.27,-4.16,;-2.18,-2.91,;-3.64,-3.39,)|

BDBM489884

CN([C@@H]1C[C@H](CS(=O)(=O)C2CN(C2)C2CCC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.24,-.48,;-4.91,-1.25,;-3.57,-.48,;-3.17,1.01,;-1.69,.61,;-.35,1.38,;.98,.61,;.21,-.72,;1.75,-.72,;2.07,1.7,;3.61,1.7,;3.61,3.24,;2.07,3.24,;4.7,4.33,;6.24,4.33,;6.24,5.87,;4.7,5.87,;-2.08,-.88,;-4.91,-2.79,;-6.24,-3.56,;-6.24,-5.1,;-4.91,-5.87,;-3.57,-5.1,;-2.11,-5.57,;-1.2,-4.33,;-2.11,-3.08,;-3.57,-3.56,)|

BDBM489885

CN([C@@H]1C[C@H](CS(=O)(=O)CC2(C)CC(F)(F)C2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.13,.17,;-4.79,-.6,;-3.7,.49,;-3.7,2.03,;-2.16,2.03,;-1.07,3.11,;.41,2.72,;-.36,1.38,;1.5,1.63,;1.35,3.94,;2.88,3.74,;2.48,5.22,;3.82,2.51,;5.04,3.45,;6.13,4.54,;5.81,2.12,;4.1,4.67,;-2.16,.49,;-4.79,-2.14,;-6.13,-2.91,;-6.13,-4.45,;-4.79,-5.22,;-3.46,-4.45,;-1.99,-4.93,;-1.09,-3.68,;-1.99,-2.44,;-3.46,-2.91,)|

BDBM489886

CO[C@H]1C[C@@H](C1)N1CC(C1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:4.6,wD:16.20,14.15,2.1,(7.53,6.01,;6.04,6.41,;4.95,5.32,;3.41,5.32,;3.41,3.78,;4.95,3.78,;2.32,2.7,;2.32,1.16,;.78,1.16,;.78,2.7,;-.31,.07,;-1.4,-1.02,;.46,-1.27,;-1.64,.84,;-2.97,.07,;-4.46,.46,;-4.86,-1.02,;-3.37,-1.42,;-6.19,-1.79,;-7.53,-1.02,;-6.19,-3.33,;-7.53,-4.1,;-7.53,-5.64,;-6.19,-6.41,;-4.86,-5.64,;-3.4,-6.12,;-2.49,-4.87,;-3.4,-3.63,;-4.86,-4.1,)|

BDBM489887

CCC(CC)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:11.13,9.8,(4.81,3.23,;4.04,1.89,;2.5,1.89,;1.73,.56,;.19,.56,;1.73,3.23,;2.13,4.71,;1.33,1.74,;.24,3.62,;-.85,2.54,;-2.39,2.54,;-2.39,1,;-.85,1,;-3.48,-.09,;-4.81,.68,;-3.48,-1.63,;-4.81,-2.4,;-4.81,-3.94,;-3.48,-4.71,;-2.14,-3.94,;-.68,-4.42,;.23,-3.17,;-.68,-1.93,;-2.14,-2.4,)|

BDBM489888

COCCCS(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:11.13,9.8,(3.65,-3.44,;2.88,-2.11,;3.65,-.78,;2.88,.56,;3.65,1.89,;2.88,3.23,;3.28,4.71,;2.49,1.74,;1.4,3.62,;.31,2.54,;-1.23,2.54,;-1.23,1,;.31,1,;-2.32,-.09,;-3.65,.68,;-2.32,-1.63,;-3.65,-2.4,;-3.65,-3.94,;-2.32,-4.71,;-.99,-3.94,;.48,-4.42,;1.38,-3.17,;.48,-1.93,;-.99,-2.4,)|

BDBM489889

CN([C@@H]1C[C@H](CS(=O)(=O)CC2CCCCC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.96,.68,;-4.63,-.09,;-3.54,1,;-3.54,2.54,;-2,2.54,;-.91,3.62,;.57,3.23,;.97,4.71,;.18,1.74,;1.34,1.89,;2.88,1.89,;3.65,.56,;5.19,.56,;5.96,1.89,;5.19,3.23,;3.65,3.23,;-2,1,;-4.63,-1.63,;-5.96,-2.4,;-5.96,-3.94,;-4.63,-4.71,;-3.3,-3.94,;-1.83,-4.42,;-.93,-3.17,;-1.83,-1.93,;-3.3,-2.4,)|

BDBM489890

CN([C@@H]1C[C@H](CS(=O)(=O)CCCF)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-3.65,.68,;-2.32,-.09,;-1.23,1,;-1.23,2.54,;.31,2.54,;1.4,3.62,;2.88,3.23,;3.28,4.71,;2.49,1.74,;3.65,1.89,;2.88,.56,;3.65,-.78,;2.88,-2.11,;.31,1,;-2.32,-1.63,;-3.65,-2.4,;-3.65,-3.94,;-2.32,-4.71,;-.99,-3.94,;.48,-4.42,;1.38,-3.17,;.48,-1.93,;-.99,-2.4,)|

BDBM489891

CN([C@@H]1C[C@H](CS(=O)(=O)C2COC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-4.4,.68,;-3.06,-.09,;-1.98,1,;-1.98,2.54,;-.44,2.54,;.65,3.62,;2.14,3.23,;2.54,4.71,;1.74,1.74,;2.91,1.89,;2.51,.4,;4,.01,;4.4,1.49,;-.44,1,;-3.06,-1.63,;-4.4,-2.4,;-4.4,-3.94,;-3.06,-4.71,;-1.73,-3.94,;-.27,-4.42,;.64,-3.17,;-.27,-1.93,;-1.73,-2.4,)|

BDBM489892

CC(C)CCS(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:11.13,9.8,(2.11,-2.11,;2.88,-.78,;4.42,-.78,;2.11,.56,;2.88,1.89,;2.11,3.23,;2.51,4.71,;1.72,1.74,;.63,3.62,;-.46,2.54,;-2,2.54,;-2,1,;-.46,1,;-3.09,-.09,;-4.42,.68,;-3.09,-1.63,;-4.42,-2.4,;-4.42,-3.94,;-3.09,-4.71,;-1.76,-3.94,;-.29,-4.42,;.61,-3.17,;-.29,-1.93,;-1.76,-2.4,)|

BDBM489893

CCC(CC)CS(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:12.14,10.9,(.57,-.78,;1.34,.56,;2.88,.56,;3.65,-.78,;2.88,-2.11,;3.65,1.89,;2.88,3.23,;3.28,4.71,;2.49,1.74,;1.4,3.62,;.31,2.54,;-1.23,2.54,;-1.23,1,;.31,1,;-2.32,-.09,;-3.65,.68,;-2.32,-1.63,;-3.65,-2.4,;-3.65,-3.94,;-2.32,-4.71,;-.99,-3.94,;.48,-4.42,;1.38,-3.17,;.48,-1.93,;-.99,-2.4,)|

BDBM489894

CN([C@@H]1C[C@H](CS(=O)(=O)CC2CCOC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.58,.68,;-4.25,-.09,;-3.16,1,;-3.16,2.54,;-1.62,2.54,;-.53,3.62,;.96,3.23,;1.35,4.71,;.56,1.74,;1.73,1.89,;3.21,2.29,;4.12,1.04,;5.58,1.52,;5.58,3.06,;4.12,3.54,;-1.62,1,;-4.25,-1.63,;-5.58,-2.4,;-5.58,-3.94,;-4.25,-4.71,;-2.92,-3.94,;-1.45,-4.42,;-.55,-3.17,;-1.45,-1.93,;-2.92,-2.4,)|

BDBM489895

CN([C@@H]1C[C@H](CS(=O)(=O)CCC2CCCC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.82,.68,;-4.48,-.09,;-3.39,1,;-3.39,2.54,;-1.85,2.54,;-.77,3.62,;.72,3.23,;1.12,4.71,;.32,1.74,;1.49,1.89,;3.03,1.89,;3.8,.56,;3.33,-.91,;4.57,-1.81,;5.82,-.91,;5.34,.56,;-1.85,1,;-4.48,-1.63,;-5.82,-2.4,;-5.82,-3.94,;-4.48,-4.71,;-3.15,-3.94,;-1.69,-4.42,;-.78,-3.17,;-1.69,-1.93,;-3.15,-2.4,)|

BDBM489896

CCC(C)CS(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:11.13,9.8,(5.58,.56,;4.04,.56,;3.27,1.89,;4.04,3.23,;1.73,1.89,;.96,3.23,;1.36,4.71,;.56,1.74,;-.53,3.62,;-1.62,2.54,;-3.16,2.54,;-3.16,1,;-1.62,1,;-4.25,-.09,;-5.58,.68,;-4.25,-1.63,;-5.58,-2.4,;-5.58,-3.94,;-4.25,-4.71,;-2.91,-3.94,;-1.45,-4.42,;-.54,-3.17,;-1.45,-1.93,;-2.91,-2.4,)|

BDBM489897

CN([C@@H]1C[C@H](CS(=O)(=O)Cc2ccccc2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.28,1.77,;-4.94,1,;-3.61,1.77,;-3.21,3.25,;-1.72,2.85,;-.39,3.62,;.94,2.85,;.17,1.52,;1.71,1.52,;2.28,3.62,;3.61,2.85,;3.61,1.31,;4.94,.54,;6.28,1.31,;6.28,2.85,;4.94,3.62,;-2.12,1.37,;-4.94,-.54,;-6.28,-1.31,;-6.28,-2.85,;-4.94,-3.62,;-3.61,-2.85,;-2.15,-3.33,;-1.24,-2.08,;-2.15,-.84,;-3.61,-1.31,)|

BDBM489898

CN([C@@H]1C[C@H](CS(=O)(=O)CCCC(F)(F)F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.04,1.49,;-3.71,.72,;-2.38,1.49,;-1.98,2.98,;-.49,2.58,;.84,3.35,;2.18,2.58,;2.57,4.06,;3.66,2.98,;1.78,1.09,;2.87,,;2.47,-1.49,;3.56,-2.58,;3.16,-4.06,;5.04,-2.18,;2.22,-3.35,;-.89,1.09,;-3.71,-.82,;-5.04,-1.59,;-5.04,-3.13,;-3.71,-3.9,;-2.38,-3.13,;-.91,-3.61,;-.01,-2.36,;-.91,-1.12,;-2.38,-1.59,)|

BDBM489899

CN([C@@H]1C[C@H](CS(=O)(=O)CCC(F)(F)F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-4.3,1.57,;-2.97,.8,;-1.63,1.57,;-1.23,3.05,;.25,2.66,;1.59,3.43,;2.68,2.34,;4.16,2.73,;3.07,3.82,;2.28,.85,;3.37,-.24,;2.97,-1.73,;4.06,-2.82,;1.48,-2.13,;4.3,-.96,;-.15,1.17,;-2.97,-.74,;-4.3,-1.51,;-4.3,-3.05,;-2.97,-3.82,;-1.63,-3.05,;-.17,-3.53,;.74,-2.28,;-.17,-1.04,;-1.63,-1.51,)|

BDBM489900

CC[C@@H](C)CS(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:11.13,9.8,2.2,(3.9,-2.66,;2.81,-1.57,;3.21,-.08,;4.7,.32,;2.12,1.01,;2.52,2.5,;4.01,2.89,;2.92,3.98,;1.19,3.27,;-.15,2.5,;-1.63,2.89,;-2.03,1.41,;-.54,1.01,;-3.37,.64,;-4.7,1.41,;-3.37,-.9,;-4.7,-1.67,;-4.7,-3.21,;-3.37,-3.98,;-2.03,-3.21,;-.57,-3.69,;.34,-2.44,;-.57,-1.2,;-2.03,-1.67,)|

BDBM489901

COc1cc(ccn1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:14.17,12.12,(4.94,-3.69,;4.94,-2.15,;3.61,-1.38,;3.61,.16,;2.28,.93,;.94,.16,;.94,-1.38,;2.28,-2.15,;2.28,2.47,;2.28,4.01,;3.61,3.24,;.94,3.24,;-.39,2.47,;-1.88,2.87,;-2.28,1.38,;-.79,.98,;-3.61,.61,;-4.94,1.38,;-3.61,-.93,;-4.94,-1.7,;-4.94,-3.24,;-3.61,-4.01,;-2.28,-3.24,;-.81,-3.72,;.09,-2.47,;-.81,-1.22,;-2.28,-1.7,)|

BDBM489902

CN([C@@H]1C[C@H](CS(=O)(=O)C[C@H]2CC[C@@H](CC2)C(F)(F)F)C1)c1ncnc2[nH]ccc12 |r,wU:10.9,wD:2.1,4.4,13.16,(-6.33,1.83,;-5,1.06,;-3.67,1.83,;-3.27,3.32,;-1.78,2.92,;-.45,3.69,;.89,2.92,;1.29,4.41,;2.38,3.32,;.49,1.43,;1.58,.35,;3.07,.74,;4.15,-.35,;3.76,-1.83,;2.27,-2.23,;1.18,-1.14,;4.85,-2.92,;6.33,-2.52,;4.45,-4.41,;3.51,-3.69,;-2.18,1.43,;-5,-.48,;-6.33,-1.25,;-6.33,-2.79,;-5,-3.56,;-3.67,-2.79,;-2.2,-3.26,;-1.3,-2.02,;-2.2,-.77,;-3.67,-1.25,)|

BDBM489903

COC(C)C1CCN(CC1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:16.19,14.14,(4.28,-5,;4.28,-3.47,;2.94,-2.69,;1.61,-3.47,;2.94,-1.16,;4.28,-.38,;4.28,1.15,;2.94,1.92,;1.61,1.15,;1.61,-.39,;2.94,3.47,;4.28,4.23,;2.94,5,;1.61,4.23,;.28,3.47,;-1.21,3.86,;-1.61,2.38,;-.12,1.98,;-2.94,1.61,;-4.28,2.38,;-2.94,.07,;-4.28,-.7,;-4.28,-2.24,;-2.94,-3.01,;-1.61,-2.24,;-.15,-2.72,;.76,-1.47,;-.15,-.23,;-1.61,-.7,)|

BDBM489904

CN([C@@H]1C[C@H](CS(=O)(=O)c2cccc3cccnc23)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.85,.28,;-4.51,-.49,;-3.42,.6,;-3.42,2.14,;-1.88,2.14,;-.79,3.23,;.69,2.83,;1.09,4.31,;.29,1.34,;2.18,3.23,;2.58,4.71,;4.07,5.11,;5.16,4.02,;4.76,2.54,;5.85,1.45,;5.45,-.04,;3.96,-.44,;2.87,.65,;3.27,2.14,;-1.88,.6,;-4.51,-2.03,;-5.85,-2.8,;-5.85,-4.34,;-4.51,-5.11,;-3.18,-4.34,;-1.71,-4.82,;-.81,-3.57,;-1.71,-2.33,;-3.18,-2.8,)|

BDBM489905

COC1CC11CCN(CC1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,w:2.1,wD:16.20,14.15,(6.59,6.29,;5.82,4.96,;4.28,4.96,;2.94,5.73,;2.94,4.19,;3.71,2.85,;2.94,1.52,;1.4,1.52,;.63,2.85,;1.4,4.19,;.63,.19,;-.14,-1.15,;1.97,-.58,;-.7,.96,;-2.03,.19,;-3.52,.59,;-3.92,-.9,;-2.43,-1.3,;-5.25,-1.67,;-6.59,-.9,;-5.25,-3.21,;-6.59,-3.98,;-6.59,-5.52,;-5.25,-6.29,;-3.92,-5.52,;-2.46,-6,;-1.55,-4.75,;-2.46,-3.51,;-3.92,-3.98,)|

BDBM489906

CN([C@@H]1C[C@H](CS(=O)(=O)CCCC(F)F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-4.85,1.61,;-3.51,.84,;-2.18,1.61,;-1.78,3.09,;-.29,2.69,;1.04,3.47,;2.38,2.69,;3.46,3.78,;1.29,1.61,;3.46,1.61,;3.07,.12,;4.15,-.97,;3.76,-2.46,;4.85,-3.55,;2.27,-2.86,;-.69,1.21,;-3.51,-.7,;-4.85,-1.47,;-4.85,-3.01,;-3.51,-3.78,;-2.18,-3.01,;-.71,-3.49,;.19,-2.24,;-.71,-1,;-2.18,-1.47,)|

BDBM489907

COc1ccc(c(C)n1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:15.18,13.13,(2.02,-4.26,;.93,-3.17,;1.33,-1.69,;.24,-.6,;.64,.89,;2.12,1.29,;3.21,.2,;4.7,.6,;2.81,-1.29,;2.52,2.78,;2.92,4.26,;4.01,3.17,;1.19,3.55,;-.15,2.78,;-1.63,3.17,;-2.03,1.69,;-.54,1.29,;-3.37,.92,;-4.7,1.69,;-3.37,-.62,;-4.7,-1.39,;-4.7,-2.93,;-3.37,-3.7,;-2.03,-2.93,;-.57,-3.41,;.34,-2.16,;-.57,-.92,;-2.03,-1.39,)|

BDBM489908

CN([C@@H]1C[C@H](CS(=O)(=O)c2cnc(nc2)N2CCCC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-7.49,-.11,;-6.16,-.88,;-5.07,.21,;-5.07,1.75,;-3.53,1.75,;-2.44,2.84,;-.95,2.44,;-.55,3.93,;-1.35,.95,;.54,2.84,;.93,4.33,;2.42,4.72,;3.51,3.64,;3.11,2.15,;1.63,1.75,;5,4.03,;5.47,5.5,;7.01,5.5,;7.49,4.03,;6.24,3.13,;-3.53,.21,;-6.16,-2.42,;-7.49,-3.19,;-7.49,-4.73,;-6.16,-5.5,;-4.82,-4.73,;-3.36,-5.21,;-2.45,-3.96,;-3.36,-2.71,;-4.82,-3.19,)|

BDBM489909

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCC(CC2)c2ccn(C)n2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-7.4,.68,;-6.07,-.09,;-4.98,1,;-4.98,2.54,;-3.44,2.54,;-2.35,3.62,;-.86,3.23,;-1.26,4.71,;.23,4.31,;.23,2.14,;-.17,.65,;.92,-.44,;2.4,-.04,;2.8,1.45,;1.71,2.54,;3.49,-1.13,;3.49,-2.67,;4.96,-3.15,;5.86,-1.9,;7.4,-1.9,;4.96,-.65,;-3.44,1,;-6.07,-1.63,;-7.4,-2.4,;-7.4,-3.94,;-6.07,-4.71,;-4.73,-3.94,;-3.27,-4.42,;-2.37,-3.17,;-3.27,-1.93,;-4.73,-2.4,)|

BDBM489910

CN([C@@H]1C[C@H](CS(=O)(=O)c2cccc3n(C)ncc23)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.66,-.88,;-4.33,-1.65,;-3.24,-.56,;-3.24,.98,;-1.7,.98,;-.61,2.07,;.88,1.67,;1.27,3.16,;.48,.19,;2.36,2.07,;3.45,.98,;4.94,1.38,;5.34,2.87,;4.25,3.96,;4.33,5.5,;5.66,6.27,;2.89,6.05,;1.92,4.85,;2.76,3.56,;-1.7,-.56,;-4.33,-3.19,;-5.66,-3.96,;-5.66,-5.5,;-4.33,-6.27,;-3,-5.5,;-1.53,-5.97,;-.63,-4.73,;-1.53,-3.48,;-3,-3.96,)|

BDBM489911

COc1ccc(c(n1)C(F)(F)F)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:18.21,16.16,(3.61,-4.08,;4.38,-2.74,;3.61,-1.41,;2.07,-1.41,;1.3,-.08,;2.07,1.26,;3.61,1.26,;4.38,-.08,;4.38,2.59,;5.92,2.59,;3.61,3.92,;5.15,3.92,;1.3,2.59,;.9,4.08,;2.07,3.92,;-.03,3.36,;-1.37,2.59,;-2.85,2.99,;-3.25,1.5,;-1.77,1.1,;-4.59,.73,;-5.92,1.5,;-4.59,-.81,;-5.92,-1.58,;-5.92,-3.12,;-4.59,-3.89,;-3.25,-3.12,;-1.79,-3.59,;-.88,-2.35,;-1.79,-1.1,;-3.25,-1.58,)|

BDBM489912

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccccc2OC(F)(F)F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.5,.28,;-4.17,-.49,;-3.08,.6,;-3.08,2.14,;-1.54,2.14,;-.45,3.23,;1.04,2.83,;1.44,4.31,;.64,1.34,;2.53,3.23,;2.92,4.71,;4.41,5.11,;5.5,4.02,;5.1,2.54,;3.61,2.14,;3.22,.65,;4.31,-.44,;5.39,-1.53,;5.39,.65,;3.22,-1.53,;-1.54,.6,;-4.17,-2.03,;-5.5,-2.8,;-5.5,-4.34,;-4.17,-5.11,;-2.83,-4.34,;-1.37,-4.82,;-.46,-3.57,;-1.37,-2.33,;-2.83,-2.8,)|

BDBM489913

CN([C@@H]1C[C@H](CS(=O)(=O)c2cc(C)ccc2C)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.85,-.07,;-4.51,-.84,;-3.42,.25,;-3.42,1.79,;-1.88,1.79,;-.79,2.88,;.69,2.48,;1.09,3.97,;.29,.99,;2.18,2.88,;3.27,1.79,;4.76,2.19,;5.85,1.1,;5.16,3.68,;4.07,4.77,;2.58,4.37,;1.49,5.46,;-1.88,.25,;-4.51,-2.38,;-5.85,-3.15,;-5.85,-4.69,;-4.51,-5.46,;-3.18,-4.69,;-1.71,-5.16,;-.81,-3.92,;-1.71,-2.67,;-3.18,-3.15,)|

BDBM489914

COc1ccc(c(F)c1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:15.18,13.13,(6.79,2.99,;5.7,4.08,;4.21,3.68,;3.81,2.19,;2.33,1.79,;1.24,2.88,;1.64,4.37,;.55,5.46,;3.12,4.77,;-.25,2.48,;.15,3.97,;-.65,.99,;-1.74,2.88,;-2.83,1.79,;-4.37,1.79,;-4.37,.25,;-2.83,.25,;-5.46,-.84,;-6.79,-.07,;-5.46,-2.38,;-6.79,-3.15,;-6.79,-4.69,;-5.46,-5.46,;-4.12,-4.69,;-2.66,-5.16,;-1.75,-3.92,;-2.66,-2.67,;-4.12,-3.15,)|

BDBM489915

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccc(C)nc2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.24,.28,;-4.91,-.49,;-3.82,.6,;-3.82,2.14,;-2.28,2.14,;-1.19,3.23,;.29,2.83,;.69,4.31,;-.1,1.34,;1.78,3.23,;2.18,4.71,;3.67,5.11,;4.76,4.02,;6.24,4.42,;4.36,2.54,;2.87,2.14,;-2.28,.6,;-4.91,-2.03,;-6.24,-2.8,;-6.24,-4.34,;-4.91,-5.11,;-3.58,-4.34,;-2.11,-4.82,;-1.21,-3.57,;-2.11,-2.33,;-3.58,-2.8,)|

BDBM489916

COc1cc(C)c(cn1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:15.18,13.13,(2.36,-4.26,;1.27,-3.17,;1.67,-1.69,;.58,-.6,;.98,.89,;.58,2.38,;2.47,1.29,;3.56,.2,;3.16,-1.29,;2.87,2.78,;3.27,4.26,;4.35,3.17,;1.53,3.55,;.2,2.78,;-1.29,3.17,;-1.69,1.69,;-.2,1.29,;-3.02,.92,;-4.35,1.69,;-3.02,-.62,;-4.35,-1.39,;-4.35,-2.93,;-3.02,-3.7,;-1.69,-2.93,;-.22,-3.41,;.68,-2.16,;-.22,-.92,;-1.69,-1.39,)|

BDBM489917

CN([C@@H]1C[C@H](CS(=O)(=O)c2c(C)noc2C)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.2,-.07,;-3.86,-.84,;-2.78,.25,;-2.78,1.79,;-1.24,1.79,;-.15,2.88,;1.34,2.48,;1.74,3.97,;.94,.99,;2.83,2.88,;3.73,4.12,;2.96,5.46,;5.2,3.65,;5.2,2.11,;3.73,1.63,;2.96,.3,;-1.24,.25,;-3.86,-2.38,;-5.2,-3.15,;-5.2,-4.69,;-3.86,-5.46,;-2.53,-4.69,;-1.07,-5.16,;-.16,-3.92,;-1.07,-2.67,;-2.53,-3.15,)|

BDBM489918

CN([C@@H]1C[C@H](CS(=O)(=O)c2cc(ccc2Cl)C(F)(F)F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.39,-.07,;-5.06,-.84,;-3.97,.25,;-3.97,1.79,;-2.43,1.79,;-1.34,2.88,;.15,2.48,;.55,3.97,;-.25,.99,;1.64,2.88,;2.73,1.79,;4.21,2.19,;4.61,3.68,;3.52,4.77,;2.03,4.37,;.95,5.46,;5.3,1.1,;6.39,.01,;4.21,.01,;6.39,2.19,;-2.43,.25,;-5.06,-2.38,;-6.39,-3.15,;-6.39,-4.69,;-5.06,-5.46,;-3.72,-4.69,;-2.26,-5.16,;-1.35,-3.92,;-2.26,-2.67,;-3.72,-3.15,)|

BDBM489919

CN([C@@H]1C[C@H](CS(=O)(=O)CCCCO)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.53,1.22,;-5.19,.45,;-4.1,1.54,;-4.1,3.08,;-2.56,3.08,;-1.48,4.17,;-.14,3.4,;-.91,2.07,;.63,2.07,;1.19,4.17,;2.53,3.4,;3.86,4.17,;5.19,3.4,;6.53,4.17,;-2.56,1.54,;-5.19,-1.09,;-6.53,-1.86,;-6.53,-3.4,;-5.19,-4.17,;-3.86,-3.4,;-2.39,-3.87,;-1.49,-2.63,;-2.39,-1.38,;-3.86,-1.86,)|

BDBM489920

CN([C@@H]1C[C@H](CS(=O)(=O)CCCCF)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.39,.19,;-5.06,-.58,;-3.97,.5,;-3.97,2.04,;-2.43,2.04,;-1.34,3.13,;.15,2.73,;-.25,1.25,;1.48,1.96,;1.24,3.82,;2.73,3.43,;3.81,4.51,;5.3,4.12,;6.39,5.2,;-2.43,.5,;-5.06,-2.12,;-6.39,-2.89,;-6.39,-4.43,;-5.06,-5.2,;-3.72,-4.43,;-2.26,-4.91,;-1.35,-3.66,;-2.26,-2.42,;-3.72,-2.89,)|

BDBM489921

CCOc1cccc(c1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:15.18,13.13,(7.13,.76,;6.05,1.85,;4.56,1.45,;3.47,2.54,;3.87,4.02,;2.78,5.11,;1.29,4.71,;.89,3.23,;1.98,2.14,;-.6,2.83,;-.2,4.31,;-.99,1.34,;-2.08,3.23,;-3.17,2.14,;-4.71,2.14,;-4.71,.6,;-3.17,.6,;-5.8,-.49,;-7.13,.28,;-5.8,-2.03,;-7.13,-2.8,;-7.13,-4.34,;-5.8,-5.11,;-4.47,-4.34,;-3,-4.82,;-2.1,-3.57,;-3,-2.33,;-4.47,-2.8,)|

BDBM489922

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccnc(C)c2C)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-4.94,1.38,;-3.61,.61,;-2.28,1.38,;-1.88,2.87,;-.39,2.47,;.94,3.24,;2.28,2.47,;2.28,4.01,;3.61,3.24,;2.28,.93,;.94,.16,;.94,-1.38,;2.28,-2.15,;3.61,-1.38,;4.94,-2.15,;3.61,.16,;4.94,.93,;-.79,.98,;-3.61,-.93,;-4.94,-1.7,;-4.94,-3.24,;-3.61,-4.01,;-2.28,-3.24,;-.81,-3.72,;.09,-2.47,;-.81,-1.22,;-2.28,-1.7,)|

BDBM489923

CCOc1ccc(cc1Cl)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:16.19,14.14,(5.35,6.06,;6.44,4.97,;6.05,3.48,;4.56,3.08,;4.16,1.59,;2.67,1.19,;1.58,2.28,;1.98,3.77,;3.47,4.17,;3.87,5.66,;.1,1.88,;.49,3.37,;-.3,.4,;-1.39,2.28,;-2.48,1.19,;-4.02,1.19,;-4.02,-.35,;-2.48,-.35,;-5.11,-1.44,;-6.44,-.67,;-5.11,-2.98,;-6.44,-3.75,;-6.44,-5.29,;-5.11,-6.06,;-3.78,-5.29,;-2.31,-5.76,;-1.41,-4.52,;-2.31,-3.27,;-3.78,-3.75,)|

BDBM489924

COc1ccc(F)cc1S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:15.18,13.13,(4.31,-1.18,;3.22,-.09,;3.61,1.39,;5.1,1.79,;5.5,3.28,;4.41,4.37,;4.81,5.86,;2.92,3.97,;2.53,2.48,;1.04,2.08,;1.44,3.57,;.64,.6,;-.45,2.48,;-1.54,1.39,;-3.08,1.39,;-3.08,-.15,;-1.54,-.15,;-4.17,-1.24,;-5.5,-.47,;-4.17,-2.78,;-5.5,-3.55,;-5.5,-5.09,;-4.17,-5.86,;-2.83,-5.09,;-1.37,-5.56,;-.46,-4.32,;-1.37,-3.07,;-2.83,-3.55,)|

BDBM489925

CN([C@@H]1C[C@H](CS(=O)(=O)c2cccnc2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.5,.28,;-4.17,-.49,;-3.08,.6,;-3.08,2.14,;-1.54,2.14,;-.45,3.23,;1.04,2.83,;1.44,4.31,;.64,1.34,;2.53,3.23,;3.61,2.14,;5.1,2.54,;5.5,4.02,;4.41,5.11,;2.92,4.71,;-1.54,.6,;-4.17,-2.03,;-5.5,-2.8,;-5.5,-4.34,;-4.17,-5.11,;-2.83,-4.34,;-1.37,-4.82,;-.46,-3.57,;-1.37,-2.33,;-2.83,-2.8,)|

BDBM489926

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccc3nn(C)cc3c2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.94,-.33,;-5.61,-1.1,;-4.52,-.01,;-4.52,1.53,;-2.98,1.53,;-1.89,2.62,;-.4,2.22,;-.01,3.7,;-.8,.73,;1.08,2.62,;1.99,1.37,;3.52,1.53,;4.15,2.94,;5.61,3.41,;5.61,4.95,;6.94,5.72,;4.15,5.43,;3.24,4.18,;1.71,4.02,;-2.98,-.01,;-5.61,-2.64,;-6.94,-3.41,;-6.94,-4.95,;-5.61,-5.72,;-4.28,-4.95,;-2.81,-5.43,;-1.91,-4.18,;-2.81,-2.94,;-4.28,-3.41,)|

BDBM489927

CC(O)CCS(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:11.13,9.8,(5.86,2.63,;4.53,3.4,;4.53,4.94,;3.19,2.63,;1.86,3.4,;.53,2.63,;-.24,1.3,;1.3,1.3,;-.81,3.4,;-1.9,2.31,;-3.44,2.31,;-3.44,.77,;-1.9,.77,;-4.53,-.32,;-5.86,.45,;-4.53,-1.86,;-5.86,-2.63,;-5.86,-4.17,;-4.53,-4.94,;-3.19,-4.17,;-1.73,-4.64,;-.82,-3.4,;-1.73,-2.15,;-3.19,-2.63,)|

BDBM489928

CCOc1ccc(cc1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:15.18,13.13,(7.53,3.73,;6.05,3.33,;4.96,4.42,;3.47,4.02,;3.07,2.54,;1.58,2.14,;.49,3.23,;.89,4.71,;2.38,5.11,;-.99,2.83,;-.6,4.31,;-1.39,1.34,;-2.48,3.23,;-3.57,2.14,;-5.11,2.14,;-5.11,.6,;-3.57,.6,;-6.2,-.49,;-7.53,.28,;-6.2,-2.03,;-7.53,-2.8,;-7.53,-4.34,;-6.2,-5.11,;-4.87,-4.34,;-3.4,-4.82,;-2.5,-3.57,;-3.4,-2.33,;-4.87,-2.8,)|

BDBM489929

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccc3n(C)ncc3c2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.94,-.19,;-5.61,-.96,;-4.52,.13,;-4.52,1.67,;-2.98,1.67,;-1.89,2.76,;-.4,2.36,;-.01,3.85,;-.8,.88,;1.08,2.76,;1.99,1.52,;3.52,1.68,;4.15,3.08,;5.61,3.56,;6.94,2.79,;5.61,5.1,;4.15,5.58,;3.24,4.33,;1.71,4.17,;-2.98,.13,;-5.61,-2.5,;-6.94,-3.27,;-6.94,-4.81,;-5.61,-5.58,;-4.28,-4.81,;-2.81,-5.28,;-1.91,-4.04,;-2.81,-2.79,;-4.28,-3.27,)|

BDBM489930

CN([C@@H]1C[C@H](CS(=O)(=O)c2cnccc2C(F)(F)F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.61,1.38,;-4.28,.61,;-2.94,1.38,;-2.55,2.87,;-1.06,2.47,;.28,3.24,;1.61,2.47,;2.94,3.24,;1.61,4.01,;1.61,.93,;.28,.16,;.28,-1.38,;1.61,-2.15,;2.94,-1.38,;2.94,.16,;4.28,.93,;5.61,.16,;4.28,2.47,;4.68,-.56,;-1.46,.98,;-4.28,-.93,;-5.61,-1.7,;-5.61,-3.24,;-4.28,-4.01,;-2.94,-3.24,;-1.48,-3.72,;-.57,-2.47,;-1.48,-1.22,;-2.94,-1.7,)|

BDBM489931

CN([C@@H]1C[C@H](CS(=O)(=O)C[C@H]2CC[C@H](CC2)C(F)(F)F)C1)c1ncnc2[nH]ccc12 |r,wU:10.9,13.16,wD:2.1,4.4,(-6.21,2.15,;-4.88,1.38,;-3.54,2.15,;-3.14,3.64,;-1.66,3.24,;-.32,4.01,;.77,2.92,;2.25,3.32,;1.16,4.41,;.37,1.43,;1.46,.35,;2.94,.74,;4.03,-.35,;3.63,-1.83,;2.15,-2.23,;1.06,-1.14,;4.72,-2.92,;6.21,-2.52,;4.32,-4.41,;3.39,-3.69,;-2.06,1.75,;-4.88,-.16,;-6.21,-.93,;-6.21,-2.47,;-4.88,-3.24,;-3.54,-2.47,;-2.08,-2.94,;-1.17,-1.7,;-2.08,-.45,;-3.54,-.93,)|

BDBM489932

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccc(cc2)C(F)(F)F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.99,-.12,;-5.65,-.89,;-4.57,.2,;-4.57,1.74,;-3.03,1.74,;-1.94,2.83,;-.45,2.43,;-.05,3.92,;-.85,.94,;1.04,2.83,;2.13,1.74,;3.61,2.14,;4.01,3.62,;2.92,4.71,;1.44,4.31,;5.5,4.02,;6.99,4.42,;5.9,2.54,;5.1,5.51,;-3.03,.2,;-5.65,-2.43,;-6.99,-3.2,;-6.99,-4.74,;-5.65,-5.51,;-4.32,-4.74,;-2.86,-5.22,;-1.95,-3.97,;-2.86,-2.72,;-4.32,-3.2,)|

BDBM489933

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCC3(CC3(F)F)CC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.61,-.07,;-5.28,-.84,;-3.94,-.07,;-3.54,1.42,;-2.06,1.02,;-.72,1.79,;.37,.7,;1.46,-.39,;-.72,-.39,;1.46,1.79,;2.94,1.39,;4.03,2.48,;3.63,3.97,;4.03,5.46,;5.12,4.37,;6.61,4.77,;5.89,3.03,;2.15,4.37,;1.06,3.28,;-2.45,-.47,;-5.28,-2.38,;-6.61,-3.15,;-6.61,-4.69,;-5.28,-5.46,;-3.94,-4.69,;-2.48,-5.16,;-1.57,-3.92,;-2.48,-2.67,;-3.94,-3.15,)|

BDBM489934

CN([C@@H]1C[C@H](CS(=O)(=O)N2CC[C@H](C2)OC(F)F)C1)c1ncnc2[nH]ccc12 |r,wU:12.14,wD:2.1,4.4,(-4.56,.73,;-3.22,-.04,;-2.14,1.05,;-2.14,2.59,;-.6,2.59,;.49,3.68,;1.98,3.28,;3.07,4.37,;1.58,4.77,;2.38,1.79,;3.84,1.31,;3.84,-.23,;2.38,-.7,;1.47,.54,;1.98,-2.19,;3.07,-3.28,;4.56,-2.88,;2.67,-4.77,;-.6,1.05,;-3.22,-1.58,;-4.56,-2.35,;-4.56,-3.89,;-3.22,-4.66,;-1.89,-3.89,;-.43,-4.37,;.48,-3.12,;-.43,-1.88,;-1.89,-2.35,)|

BDBM489935

COc1cc(c(C)cn1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:15.18,13.13,(4.94,-3.69,;4.94,-2.15,;3.61,-1.38,;3.61,.16,;2.28,.93,;.94,.16,;-.39,.93,;.94,-1.38,;2.28,-2.15,;2.28,2.47,;3.61,3.24,;2.28,4.01,;.94,3.24,;-.39,2.47,;-1.88,2.87,;-2.28,1.38,;-.79,.98,;-3.61,.61,;-4.94,1.38,;-3.61,-.93,;-4.94,-1.7,;-4.94,-3.24,;-3.61,-4.01,;-2.28,-3.24,;-.81,-3.72,;.09,-2.47,;-.81,-1.22,;-2.28,-1.7,)|

BDBM489936

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccc(nc2)C(F)(F)F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-4.28,1.61,;-2.94,.84,;-1.61,1.61,;-1.21,3.09,;.28,2.69,;1.61,3.47,;2.94,2.69,;4.28,3.47,;2.94,4.23,;2.94,1.15,;1.61,.38,;1.61,-1.15,;2.94,-1.93,;4.28,-1.15,;4.28,.38,;2.94,-3.46,;4.28,-4.23,;1.61,-4.23,;1.46,-3.07,;-.12,1.21,;-2.94,-.7,;-4.28,-1.47,;-4.28,-3.01,;-2.94,-3.78,;-1.61,-3.01,;-.15,-3.49,;.76,-2.24,;-.15,-1,;-1.61,-1.47,)|

BDBM489937

COc1cc(Cl)ccc1S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:15.18,13.13,(1.49,6.2,;1.09,4.71,;2.18,3.62,;3.67,4.02,;4.76,2.93,;6.24,3.33,;4.36,1.45,;2.87,1.05,;1.78,2.14,;.29,1.74,;.69,3.23,;-.1,.25,;-1.19,2.14,;-2.28,1.05,;-3.82,1.05,;-3.82,-.49,;-2.28,-.49,;-4.91,-1.58,;-6.24,-.81,;-4.91,-3.12,;-6.24,-3.89,;-6.24,-5.43,;-4.91,-6.2,;-3.58,-5.43,;-2.11,-5.91,;-1.21,-4.66,;-2.11,-3.42,;-3.58,-3.89,)|

BDBM489938

CN([C@@H]1C[C@H](CS(=O)(=O)c2cccc3cnn(C)c23)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.72,.28,;-4.39,-.49,;-3.3,.6,;-3.3,2.14,;-1.76,2.14,;-.67,3.23,;.82,2.83,;1.22,4.31,;.42,1.34,;2.31,3.23,;2.7,4.71,;4.19,5.11,;5.28,4.02,;4.88,2.54,;5.72,1.24,;4.75,.05,;3.31,.6,;1.98,-.17,;3.39,2.14,;-1.76,.6,;-4.39,-2.03,;-5.72,-2.8,;-5.72,-4.34,;-4.39,-5.11,;-3.05,-4.34,;-1.59,-4.82,;-.68,-3.57,;-1.59,-2.33,;-3.05,-2.8,)|

BDBM489939

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccc(C)nc2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-4.28,1.38,;-2.94,.61,;-1.61,1.38,;-1.21,2.87,;.28,2.47,;1.61,3.24,;2.94,2.47,;4.28,3.24,;2.94,4.01,;2.94,.93,;4.28,.16,;4.28,-1.38,;2.94,-2.15,;2.94,-3.69,;1.61,-1.38,;1.61,.16,;-.12,.98,;-2.94,-.93,;-4.28,-1.7,;-4.28,-3.24,;-2.94,-4.01,;-1.61,-3.24,;-.15,-3.72,;.76,-2.47,;-.15,-1.22,;-1.61,-1.7,)|

BDBM489940

CN([C@@H]1C[C@H](CS(=O)(=O)c2cccc(F)c2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.5,-.47,;-4.17,-1.24,;-3.08,-.15,;-3.08,1.39,;-1.54,1.39,;-.45,2.48,;1.04,2.08,;1.44,3.57,;.64,.6,;2.53,2.48,;3.61,1.39,;5.1,1.79,;5.5,3.28,;4.41,4.37,;4.81,5.86,;2.92,3.97,;-1.54,-.15,;-4.17,-2.78,;-5.5,-3.55,;-5.5,-5.09,;-4.17,-5.86,;-2.83,-5.09,;-1.37,-5.56,;-.46,-4.32,;-1.37,-3.07,;-2.83,-3.55,)|

BDBM489941

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCC(CC2)C(F)F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.94,-.16,;-5.61,-.93,;-4.28,-.16,;-3.88,1.33,;-2.39,.93,;-1.06,1.7,;.28,.93,;-.49,-.4,;1.05,-.4,;1.61,1.7,;2.94,.93,;4.28,1.7,;4.28,3.24,;2.94,4.01,;1.61,3.24,;5.61,4.01,;6.94,3.24,;5.61,5.55,;-2.79,-.56,;-5.61,-2.47,;-6.94,-3.24,;-6.94,-4.78,;-5.61,-5.55,;-4.28,-4.78,;-2.81,-5.26,;-1.91,-4.01,;-2.81,-2.76,;-4.28,-3.24,)|

BDBM489942

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccccc2F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.5,-.07,;-4.17,-.84,;-3.08,.25,;-3.08,1.79,;-1.54,1.79,;-.45,2.88,;1.04,2.48,;1.44,3.97,;.64,.99,;2.53,2.88,;3.61,1.79,;5.1,2.19,;5.5,3.68,;4.41,4.77,;2.92,4.37,;1.84,5.46,;-1.54,.25,;-4.17,-2.38,;-5.5,-3.15,;-5.5,-4.69,;-4.17,-5.46,;-2.83,-4.69,;-1.37,-5.16,;-.46,-3.92,;-1.37,-2.67,;-2.83,-3.15,)|

BDBM489943

CN([C@@H]1C[C@H](CS(=O)(=O)c2cncc(F)c2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.85,.28,;-4.51,-.49,;-3.42,.6,;-3.42,2.14,;-1.88,2.14,;-.79,3.23,;.69,2.83,;1.09,4.31,;.29,1.34,;2.18,3.23,;2.58,4.71,;4.07,5.11,;5.16,4.02,;4.76,2.54,;5.85,1.45,;3.27,2.14,;-1.88,.6,;-4.51,-2.03,;-5.85,-2.8,;-5.85,-4.34,;-4.51,-5.11,;-3.18,-4.34,;-1.71,-4.82,;-.81,-3.57,;-1.71,-2.33,;-3.18,-2.8,)|

BDBM489944

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccccc2Cl)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.5,-.07,;-4.17,-.84,;-3.08,.25,;-3.08,1.79,;-1.54,1.79,;-.45,2.88,;1.04,2.48,;1.44,3.97,;.64,.99,;2.53,2.88,;3.61,1.79,;5.1,2.19,;5.5,3.68,;4.41,4.77,;2.92,4.37,;1.84,5.46,;-1.54,.25,;-4.17,-2.38,;-5.5,-3.15,;-5.5,-4.69,;-4.17,-5.46,;-2.83,-4.69,;-1.37,-5.16,;-.46,-3.92,;-1.37,-2.67,;-2.83,-3.15,)|

BDBM489945

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCS(=O)(=O)CC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.92,.23,;-4.59,-.54,;-3.25,.23,;-2.85,1.71,;-1.37,1.31,;-.03,2.08,;-.03,3.62,;-.03,5.16,;-1.57,3.62,;1.51,3.62,;2.28,4.96,;3.82,4.96,;4.59,3.62,;5.92,4.39,;5.92,2.85,;3.82,2.29,;2.28,2.29,;-1.77,-.17,;-4.59,-2.08,;-5.92,-2.85,;-5.92,-4.39,;-4.59,-5.16,;-3.25,-4.39,;-1.79,-4.87,;-.88,-3.62,;-1.79,-2.38,;-3.25,-2.85,)|

BDBM489946

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccccc2C)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.5,-.07,;-4.17,-.84,;-3.08,.25,;-3.08,1.79,;-1.54,1.79,;-.45,2.88,;1.04,2.48,;1.44,3.97,;.64,.99,;2.53,2.88,;3.61,1.79,;5.1,2.19,;5.5,3.68,;4.41,4.77,;2.92,4.37,;1.84,5.46,;-1.54,.25,;-4.17,-2.38,;-5.5,-3.15,;-5.5,-4.69,;-4.17,-5.46,;-2.83,-4.69,;-1.37,-5.16,;-.46,-3.92,;-1.37,-2.67,;-2.83,-3.15,)|

BDBM489947

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCN(C)C(=O)C2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.85,.68,;-4.51,-.09,;-3.42,1,;-3.42,2.54,;-1.88,2.54,;-.79,3.62,;.69,3.23,;1.78,4.31,;.29,4.71,;1.78,2.14,;1.38,.65,;2.47,-.44,;3.96,-.04,;5.05,-1.13,;4.36,1.45,;5.85,1.85,;3.27,2.54,;-1.88,1,;-4.51,-1.63,;-5.85,-2.4,;-5.85,-3.94,;-4.51,-4.71,;-3.18,-3.94,;-1.71,-4.42,;-.81,-3.17,;-1.71,-1.93,;-3.18,-2.4,)|

BDBM489948

CCOc1ccc(cn1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:15.18,13.13,(7.53,3.73,;6.05,3.33,;4.96,4.42,;3.47,4.02,;3.07,2.54,;1.58,2.14,;.49,3.23,;.89,4.71,;2.38,5.11,;-.99,2.83,;-.6,4.31,;-1.39,1.34,;-2.48,3.23,;-3.57,2.14,;-5.11,2.14,;-5.11,.6,;-3.57,.6,;-6.2,-.49,;-7.53,.28,;-6.2,-2.03,;-7.53,-2.8,;-7.53,-4.34,;-6.2,-5.11,;-4.87,-4.34,;-3.4,-4.82,;-2.5,-3.57,;-3.4,-2.33,;-4.87,-2.8,)|

BDBM489949

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCC(CC2)c2cnco2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.46,.68,;-5.12,-.09,;-4.03,1,;-4.03,2.54,;-2.49,2.54,;-1.4,3.62,;.08,3.23,;1.17,4.31,;-.31,4.71,;1.17,2.14,;.77,.65,;1.86,-.44,;3.35,-.04,;3.75,1.45,;2.66,2.54,;4.44,-1.13,;5.98,-1.13,;6.46,-2.59,;5.21,-3.5,;3.96,-2.59,;-2.49,1,;-5.12,-1.63,;-6.46,-2.4,;-6.46,-3.94,;-5.12,-4.71,;-3.79,-3.94,;-2.32,-4.42,;-1.42,-3.17,;-2.32,-1.93,;-3.79,-2.4,)|

BDBM489950

COc1cc(c(cn1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12)C(F)(F)F |r,wD:14.17,12.12,(4.38,-4,;5.15,-2.67,;4.38,-1.33,;2.84,-1.33,;2.07,,;2.84,1.33,;4.38,1.33,;5.15,,;2.07,2.67,;1.3,4,;2.84,4,;.74,3.44,;-.6,2.67,;-2.08,3.07,;-2.48,1.58,;-1,1.18,;-3.82,.81,;-5.15,1.58,;-3.82,-.73,;-5.15,-1.5,;-5.15,-3.04,;-3.82,-3.81,;-2.48,-3.04,;-1.02,-3.52,;-.11,-2.27,;-1.02,-1.03,;-2.48,-1.5,;.53,,;-1.01,,;.53,1.54,;.53,-1.54,)|

BDBM489951

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCC(COC(F)F)CC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-4.94,2.76,;-3.61,1.99,;-2.28,2.76,;-1.88,4.25,;-.39,3.85,;.94,4.62,;2.28,3.85,;3.61,4.62,;2.28,5.39,;2.28,2.31,;.94,1.54,;.94,,;2.28,-.77,;2.28,-2.31,;3.61,-3.08,;3.61,-4.62,;2.28,-5.39,;4.94,-5.39,;3.61,,;3.61,1.54,;-.79,2.36,;-3.61,.45,;-4.94,-.32,;-4.94,-1.86,;-3.61,-2.63,;-2.28,-1.86,;-.81,-2.33,;.09,-1.09,;-.81,.16,;-2.28,-.32,)|

BDBM489952

COc1ncc(cn1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:14.17,12.12,(1.61,-4.24,;2.94,-3.47,;2.94,-1.93,;1.61,-1.15,;1.61,.39,;2.94,1.15,;4.28,.38,;4.28,-1.16,;2.94,2.7,;4.28,3.47,;2.94,4.24,;1.61,3.47,;.28,2.7,;-1.21,3.09,;-1.61,1.61,;-.12,1.21,;-2.94,.84,;-4.28,1.61,;-2.94,-.7,;-4.28,-1.47,;-4.28,-3.01,;-2.94,-3.78,;-1.61,-3.01,;-.15,-3.49,;.76,-2.24,;-.15,-1,;-1.61,-1.47,)|

BDBM489953

CN([C@@H]1C[C@H](CS(=O)(=O)c2cccc3cnccc23)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.5,-1.01,;-4.17,-1.78,;-3.08,-.69,;-3.08,.85,;-1.54,.85,;-.45,1.94,;1.04,1.54,;1.44,3.03,;.64,.05,;2.53,1.94,;3.61,.85,;5.1,1.25,;5.5,2.73,;4.41,3.82,;4.81,5.31,;3.72,6.4,;2.23,6,;1.84,4.51,;2.92,3.43,;-1.54,-.69,;-4.17,-3.32,;-5.5,-4.09,;-5.5,-5.63,;-4.17,-6.4,;-2.83,-5.63,;-1.37,-6.11,;-.46,-4.86,;-1.37,-3.61,;-2.83,-4.09,)|

BDBM489954

COc1cc(cnc1OC)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:16.19,14.14,(5.35,6.06,;3.87,5.66,;3.47,4.17,;1.98,3.77,;1.58,2.28,;2.67,1.19,;4.16,1.59,;4.56,3.08,;6.05,3.48,;6.44,4.97,;.1,1.88,;.49,3.37,;-.3,.4,;-1.39,2.28,;-2.48,1.19,;-4.02,1.19,;-4.02,-.35,;-2.48,-.35,;-5.11,-1.44,;-6.44,-.67,;-5.11,-2.98,;-6.44,-3.75,;-6.44,-5.29,;-5.11,-6.06,;-3.78,-5.29,;-2.31,-5.76,;-1.41,-4.52,;-2.31,-3.27,;-3.78,-3.75,)|

BDBM489955

COc1ncc(c(C)n1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:15.18,13.13,(.94,-4.24,;2.28,-3.47,;2.28,-1.93,;.94,-1.15,;.94,.39,;2.28,1.15,;3.61,.38,;4.94,1.16,;3.61,-1.16,;2.28,2.7,;3.61,3.47,;2.28,4.24,;.94,3.47,;-.39,2.7,;-1.88,3.09,;-2.28,1.61,;-.79,1.21,;-3.61,.84,;-4.94,1.61,;-3.61,-.7,;-4.94,-1.47,;-4.94,-3.01,;-3.61,-3.78,;-2.28,-3.01,;-.81,-3.49,;.09,-2.24,;-.81,-1,;-2.28,-1.47,)|

BDBM489956

CN([C@@H]1C[C@H](CS(=O)(=O)N2CC[C@@H](C2)S(C)(=O)=O)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,12.14,(-5.05,1.38,;-3.71,.61,;-2.38,1.38,;-1.98,2.87,;-.49,2.47,;.84,3.24,;2.17,2.47,;2.17,4.01,;3.51,3.24,;2.94,1.14,;4.48,1.14,;4.96,-.33,;3.71,-1.23,;2.47,-.33,;3.71,-2.77,;2.38,-3.54,;5.05,-3.54,;5.05,-2,;-.89,.98,;-3.71,-.93,;-5.05,-1.7,;-5.05,-3.24,;-3.71,-4.01,;-2.38,-3.24,;-.92,-3.72,;-.01,-2.47,;-.92,-1.22,;-2.38,-1.7,)|

BDBM489957

CCOc1cc(ccn1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:15.18,13.13,(7.13,.76,;6.05,1.85,;4.56,1.45,;3.47,2.54,;1.98,2.14,;.89,3.23,;1.29,4.71,;2.78,5.11,;3.87,4.02,;-.6,2.83,;-.2,4.31,;-.99,1.34,;-2.08,3.23,;-3.17,2.14,;-4.71,2.14,;-4.71,.6,;-3.17,.6,;-5.8,-.49,;-7.13,.28,;-5.8,-2.03,;-7.13,-2.8,;-7.13,-4.34,;-5.8,-5.11,;-4.47,-4.34,;-3,-4.82,;-2.1,-3.57,;-3,-2.33,;-4.47,-2.8,)|

BDBM489958

CN([C@@H]1C[C@H](CS(=O)(=O)c2cccc(OC(F)(F)F)c2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.31,.28,;-4.98,-.49,;-3.89,.6,;-3.89,2.14,;-2.35,2.14,;-1.26,3.23,;.23,2.83,;.62,4.31,;-.17,1.34,;1.71,3.23,;2.11,4.71,;3.6,5.11,;4.69,4.02,;4.29,2.54,;5.38,1.45,;4.98,-.04,;3.49,-.44,;6.07,-1.13,;6.31,.73,;2.8,2.14,;-2.35,.6,;-4.98,-2.03,;-6.31,-2.8,;-6.31,-4.34,;-4.98,-5.11,;-3.65,-4.34,;-2.18,-4.82,;-1.28,-3.57,;-2.18,-2.33,;-3.65,-2.8,)|

BDBM489959

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccc3cnn(C)c3c2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.53,.33,;-5.19,-.44,;-4.1,.65,;-4.1,2.19,;-2.56,2.19,;-1.48,3.28,;.01,2.88,;.41,4.37,;-.39,1.39,;1.5,3.28,;1.97,4.74,;3.48,5.06,;4.51,3.92,;6.05,3.92,;6.53,2.45,;5.28,1.55,;5.28,.01,;4.04,2.45,;2.53,2.13,;-2.56,.65,;-5.19,-1.98,;-6.53,-2.75,;-6.53,-4.29,;-5.19,-5.06,;-3.86,-4.29,;-2.4,-4.77,;-1.49,-3.52,;-2.4,-2.28,;-3.86,-2.75,)|

BDBM489960

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCC(CC2)c2ncco2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.46,.68,;-5.12,-.09,;-4.03,1,;-4.03,2.54,;-2.49,2.54,;-1.4,3.62,;.08,3.23,;1.17,4.31,;-.31,4.71,;1.17,2.14,;.77,.65,;1.86,-.44,;3.35,-.04,;3.75,1.45,;2.66,2.54,;4.44,-1.13,;5.98,-1.13,;6.46,-2.59,;5.21,-3.5,;3.96,-2.59,;-2.49,1,;-5.12,-1.63,;-6.46,-2.4,;-6.46,-3.94,;-5.12,-4.71,;-3.79,-3.94,;-2.32,-4.42,;-1.42,-3.17,;-2.32,-1.93,;-3.79,-2.4,)|

BDBM489961

CN([C@@H]1C[C@H](CS(=O)(=O)c2cnc3ccccc3c2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.79,.28,;-5.46,-.49,;-4.37,.6,;-4.37,2.14,;-2.83,2.14,;-1.74,3.23,;-.25,2.83,;.15,4.31,;-.65,1.34,;1.24,3.23,;1.64,4.71,;3.12,5.11,;4.21,4.02,;5.7,4.42,;6.79,3.33,;6.39,1.85,;4.9,1.45,;3.81,2.54,;2.33,2.14,;-2.83,.6,;-5.46,-2.03,;-6.79,-2.8,;-6.79,-4.34,;-5.46,-5.11,;-4.12,-4.34,;-2.66,-4.82,;-1.75,-3.57,;-2.66,-2.33,;-4.12,-2.8,)|

BDBM489962

COC(C)c1ccc(cc1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:16.19,14.14,(5.01,6.06,;6.1,4.97,;5.7,3.48,;6.79,2.39,;4.21,3.08,;3.81,1.59,;2.33,1.19,;1.24,2.28,;1.64,3.77,;3.12,4.17,;-.25,1.88,;.15,3.37,;-.65,.4,;-1.74,2.28,;-2.83,1.19,;-4.37,1.19,;-4.37,-.35,;-2.83,-.35,;-5.46,-1.44,;-6.79,-.67,;-5.46,-2.98,;-6.79,-3.75,;-6.79,-5.29,;-5.46,-6.06,;-4.12,-5.29,;-2.66,-5.76,;-1.75,-4.52,;-2.66,-3.27,;-4.12,-3.75,)|

BDBM489963

COc1cncc(c1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:14.17,12.12,(3.85,-4.06,;4.25,-2.58,;3.16,-1.49,;1.67,-1.89,;.58,-.8,;.98,.69,;2.47,1.09,;3.56,,;2.87,2.58,;4.35,2.98,;3.27,4.06,;1.53,3.35,;.2,2.58,;-1.29,2.98,;-1.69,1.49,;-.2,1.09,;-3.02,.72,;-4.35,1.49,;-3.02,-.82,;-4.35,-1.59,;-4.35,-3.13,;-3.02,-3.9,;-1.69,-3.13,;-.22,-3.61,;.68,-2.36,;-.22,-1.12,;-1.69,-1.59,)|

BDBM489965

CN([C@@H]1C[C@H](CS(=O)(=O)CC2(C)CCC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-4.4,.68,;-3.07,-.09,;-1.98,1,;-1.98,2.54,;-.44,2.54,;.65,3.62,;2.14,3.23,;3.22,4.31,;1.74,4.71,;3.47,2.46,;3.07,.97,;4.4,1.74,;1.74,.2,;2.51,-1.14,;3.84,-.37,;-.44,1,;-3.07,-1.63,;-4.4,-2.4,;-4.4,-3.94,;-3.07,-4.71,;-1.74,-3.94,;-.27,-4.42,;.63,-3.17,;-.27,-1.93,;-1.74,-2.4,)|

BDBM489966

CN([C@@H]1C[C@H](CS(=O)(=O)c2cccc(c2)C(F)(F)F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.9,-1.21,;-4.57,-1.98,;-3.48,-.89,;-3.48,.65,;-1.94,.65,;-.85,1.74,;.64,1.34,;1.04,2.83,;.24,-.15,;2.13,1.74,;3.22,.65,;4.7,1.05,;5.1,2.54,;4.01,3.62,;2.53,3.23,;4.41,5.11,;4.81,6.6,;2.92,5.51,;5.9,4.71,;-1.94,-.89,;-4.57,-3.52,;-5.9,-4.29,;-5.9,-5.83,;-4.57,-6.6,;-3.23,-5.83,;-1.77,-6.31,;-.86,-5.06,;-1.77,-3.81,;-3.23,-4.29,)|

BDBM50243908

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccccc2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(6.34,-12.52,;7.67,-13.29,;9,-12.51,;9.39,-11.02,;10.88,-11.41,;12.21,-10.64,;13.54,-11.4,;14.3,-12.73,;12.77,-12.72,;14.87,-10.63,;16.2,-11.41,;17.54,-10.64,;17.54,-9.1,;16.2,-8.33,;14.87,-9.1,;10.49,-12.9,;7.68,-14.82,;6.35,-15.59,;6.35,-17.14,;7.68,-17.91,;9.02,-17.13,;10.49,-17.6,;11.39,-16.34,;10.47,-15.1,;9.01,-15.59,)|

BDBM489968

CN([C@@H]1C[C@H](CS(=O)(=O)c2cnc(C)cc2C)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-4.94,1.38,;-3.61,.61,;-2.28,1.38,;-1.88,2.87,;-.39,2.47,;.94,3.24,;2.28,2.47,;3.61,3.24,;2.28,4.01,;2.28,.93,;.94,.16,;.94,-1.38,;2.28,-2.15,;2.28,-3.69,;3.61,-1.38,;3.61,.16,;4.94,.93,;-.79,.98,;-3.61,-.93,;-4.94,-1.7,;-4.94,-3.24,;-3.61,-4.01,;-2.28,-3.24,;-.81,-3.72,;.09,-2.47,;-.81,-1.22,;-2.28,-1.7,)|

BDBM489969

COc1ccc(cn1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:14.17,12.12,(6.44,5.51,;6.05,4.02,;4.56,3.62,;3.47,4.71,;1.98,4.31,;1.58,2.83,;2.67,1.74,;4.16,2.14,;.1,2.43,;.49,3.92,;-.3,.94,;-1.39,2.83,;-2.48,1.74,;-4.02,1.74,;-4.02,.2,;-2.48,.2,;-5.11,-.89,;-6.44,-.12,;-5.11,-2.43,;-6.44,-3.2,;-6.44,-4.74,;-5.11,-5.51,;-3.78,-4.74,;-2.31,-5.22,;-1.41,-3.97,;-2.31,-2.72,;-3.78,-3.2,)|

BDBM489970

COc1cc(cnc1C)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:15.18,13.13,(4.94,-3.69,;4.94,-2.15,;3.61,-1.38,;3.61,.16,;2.28,.93,;.94,.16,;.94,-1.38,;2.28,-2.15,;2.28,-3.69,;2.28,2.47,;3.61,3.24,;2.28,4.01,;.94,3.24,;-.39,2.47,;-1.88,2.87,;-2.28,1.38,;-.79,.98,;-3.61,.61,;-4.94,1.38,;-3.61,-.93,;-4.94,-1.7,;-4.94,-3.24,;-3.61,-4.01,;-2.28,-3.24,;-.81,-3.72,;.09,-2.47,;-.81,-1.22,;-2.28,-1.7,)|

BDBM489971

CCOc1ncccc1S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:15.18,13.13,(3.72,6.4,;2.23,6,;1.84,4.51,;2.92,3.43,;4.41,3.82,;5.5,2.73,;5.1,1.25,;3.61,.85,;2.53,1.94,;1.04,1.54,;1.44,3.03,;.64,.05,;-.45,1.94,;-1.54,.85,;-3.08,.85,;-3.08,-.69,;-1.54,-.69,;-4.17,-1.78,;-5.5,-1.01,;-4.17,-3.32,;-5.5,-4.09,;-5.5,-5.63,;-4.17,-6.4,;-2.83,-5.63,;-1.37,-6.11,;-.46,-4.86,;-1.37,-3.61,;-2.83,-4.09,)|

BDBM489972

COc1cnc(C)c(c1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:15.18,13.13,(5.46,7.47,;5.46,5.93,;4.13,5.16,;2.79,5.93,;1.46,5.16,;1.46,3.62,;.13,2.85,;2.79,2.85,;4.13,3.62,;2.79,1.31,;4.33,1.31,;1.25,1.31,;2.79,-.23,;1.46,-1,;1.06,-2.48,;-.43,-2.08,;-.03,-.6,;-1.76,-2.85,;-3.09,-2.08,;-1.76,-4.39,;-.43,-5.16,;-.43,-6.7,;-1.76,-7.47,;-3.09,-6.7,;-4.56,-7.18,;-5.46,-5.93,;-4.56,-4.69,;-3.09,-5.16,)|

BDBM489973

COc1ccncc1S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:14.17,12.12,(5.61,.16,;4.28,.93,;2.94,.16,;2.94,-1.38,;1.61,-2.15,;.28,-1.38,;.28,.16,;1.61,.93,;1.61,2.47,;2.94,3.24,;1.61,4.01,;.28,3.24,;-1.06,2.47,;-2.55,2.87,;-2.94,1.38,;-1.46,.98,;-4.28,.61,;-5.61,1.38,;-4.28,-.93,;-5.61,-1.7,;-5.61,-3.24,;-4.28,-4.01,;-2.94,-3.24,;-1.48,-3.72,;-.57,-2.47,;-1.48,-1.22,;-2.94,-1.7,)|

BDBM489974

CN([C@@H]1C[C@H](CS(=O)(=O)CCC(F)F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.92,1.48,;-4.59,.71,;-3.25,1.48,;-2.85,2.97,;-1.37,2.57,;-.03,3.34,;1.3,2.57,;2.07,3.91,;2.07,1.24,;2.84,2.57,;3.61,1.24,;5.15,1.24,;5.92,-.09,;5.92,2.57,;-1.77,1.09,;-4.59,-.83,;-5.92,-1.6,;-5.92,-3.14,;-4.59,-3.91,;-3.25,-3.14,;-1.79,-3.61,;-.88,-2.37,;-1.79,-1.12,;-3.25,-1.6,)|

BDBM489975

CN([C@@H]1C[C@H](CS(=O)(=O)c2c(C)nn(C)c2C)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.93,-.18,;-4.59,-.95,;-3.5,.14,;-3.5,1.68,;-1.96,1.68,;-.87,2.77,;.61,2.37,;1.01,3.86,;.21,.88,;2.1,2.77,;2.58,4.23,;1.81,5.57,;4.12,4.23,;4.59,2.77,;5.93,2,;3.35,1.86,;3.35,.32,;-1.96,.14,;-4.59,-2.49,;-5.93,-3.26,;-5.93,-4.8,;-4.59,-5.57,;-3.26,-4.8,;-1.79,-5.27,;-.89,-4.03,;-1.79,-2.78,;-3.26,-3.26,)|

BDBM489976

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccc(Cl)cn2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.24,.28,;-4.91,-.49,;-3.82,.6,;-3.82,2.14,;-2.28,2.14,;-1.19,3.23,;.29,2.83,;.69,4.31,;-.1,1.34,;1.78,3.23,;2.87,2.14,;4.36,2.54,;4.76,4.02,;6.24,4.42,;3.67,5.11,;2.18,4.71,;-2.28,.6,;-4.91,-2.03,;-6.24,-2.8,;-6.24,-4.34,;-4.91,-5.11,;-3.58,-4.34,;-2.11,-4.82,;-1.21,-3.57,;-2.11,-2.33,;-3.58,-2.8,)|

BDBM489977

CN([C@@H]1C[C@H](CS(=O)(=O)c2cnccc2C)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-4.94,1.38,;-3.61,.61,;-2.28,1.38,;-1.88,2.87,;-.39,2.47,;.94,3.24,;2.28,2.47,;3.61,3.24,;2.28,4.01,;2.28,.93,;.94,.16,;.94,-1.38,;2.28,-2.15,;3.61,-1.38,;3.61,.16,;4.94,.93,;-.79,.98,;-3.61,-.93,;-4.94,-1.7,;-4.94,-3.24,;-3.61,-4.01,;-2.28,-3.24,;-.81,-3.72,;.09,-2.47,;-.81,-1.22,;-2.28,-1.7,)|

BDBM489978

CO[C@@H](C)C1CCN(CC1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:2.2,wD:16.19,14.14,(3.88,-4.98,;4.28,-3.49,;2.94,-2.72,;1.61,-3.49,;2.94,-1.18,;1.61,-.41,;1.61,1.13,;2.94,1.9,;4.28,1.13,;4.28,-.41,;2.94,3.44,;4.28,4.21,;2.94,4.98,;1.61,4.21,;.28,3.44,;-1.21,3.84,;-1.61,2.35,;-.12,1.95,;-2.94,1.58,;-4.28,2.35,;-2.94,.04,;-4.28,-.73,;-4.28,-2.27,;-2.94,-3.04,;-1.61,-2.27,;-.15,-2.75,;.76,-1.5,;-.15,-.25,;-1.61,-.73,)|

BDBM489979

CN([C@@H]1C[C@H](CS(=O)(=O)c2cccc3ncccc23)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.5,-1.01,;-4.17,-1.78,;-3.08,-.69,;-3.08,.85,;-1.54,.85,;-.45,1.94,;1.04,1.54,;1.44,3.03,;.64,.05,;2.53,1.94,;3.61,.85,;5.1,1.25,;5.5,2.73,;4.41,3.82,;4.81,5.31,;3.72,6.4,;2.23,6,;1.84,4.51,;2.92,3.43,;-1.54,-.69,;-4.17,-3.32,;-5.5,-4.09,;-5.5,-5.63,;-4.17,-6.4,;-2.83,-5.63,;-1.37,-6.11,;-.46,-4.86,;-1.37,-3.61,;-2.83,-4.09,)|

BDBM489980

COc1ccc(cc1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:14.17,12.12,(6.79,3.33,;5.7,4.42,;4.21,4.02,;3.12,5.11,;1.64,4.71,;1.24,3.23,;2.33,2.14,;3.81,2.54,;-.25,2.83,;.15,4.31,;-.65,1.34,;-1.74,3.23,;-2.83,2.14,;-4.37,2.14,;-4.37,.6,;-2.83,.6,;-5.46,-.49,;-6.79,.28,;-5.46,-2.03,;-6.79,-2.8,;-6.79,-4.34,;-5.46,-5.11,;-4.12,-4.34,;-2.66,-4.82,;-1.75,-3.57,;-2.66,-2.33,;-4.12,-2.8,)|

BDBM489981

CN([C@@H]1C[C@H](CS(=O)(=O)c2cnc3ccoc3c2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.53,.33,;-5.19,-.44,;-4.1,.65,;-4.1,2.19,;-2.56,2.19,;-1.48,3.28,;.01,2.88,;.41,4.37,;-.39,1.39,;1.5,3.28,;1.97,4.74,;3.48,5.06,;4.51,3.92,;6.05,3.92,;6.53,2.45,;5.28,1.55,;4.04,2.45,;2.53,2.13,;-2.56,.65,;-5.19,-1.98,;-6.53,-2.75,;-6.53,-4.29,;-5.19,-5.06,;-3.86,-4.29,;-2.4,-4.77,;-1.49,-3.52,;-2.4,-2.28,;-3.86,-2.75,)|

BDBM489982

CN([C@@H]1C[C@H](CS(=O)(=O)c2cn(C)c(=O)cc2C)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.92,-.52,;-4.59,-1.29,;-3.25,-.52,;-2.85,.97,;-1.37,.57,;-.03,1.34,;1.3,.57,;2.63,-.2,;.53,-.76,;2.07,1.91,;3.61,1.91,;4.38,3.24,;5.92,3.24,;3.61,4.57,;4.38,5.91,;2.07,4.57,;1.3,3.24,;-.24,3.24,;-1.77,-.92,;-4.59,-2.83,;-5.92,-3.6,;-5.92,-5.14,;-4.59,-5.91,;-3.25,-5.14,;-1.79,-5.61,;-.88,-4.37,;-1.79,-3.12,;-3.25,-3.6,)|

BDBM489983

COc1cncc(c1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:14.17,12.12,(3.72,6.4,;4.81,5.31,;4.41,3.82,;5.5,2.73,;5.1,1.25,;3.61,.85,;2.53,1.94,;2.92,3.43,;1.04,1.54,;1.44,3.03,;.64,.05,;-.45,1.94,;-1.54,.85,;-3.08,.85,;-3.08,-.69,;-1.54,-.69,;-4.17,-1.78,;-5.5,-1.01,;-4.17,-3.32,;-5.5,-4.09,;-5.5,-5.63,;-4.17,-6.4,;-2.83,-5.63,;-1.37,-6.11,;-.46,-4.86,;-1.37,-3.61,;-2.83,-4.09,)|

BDBM489984

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccc(=O)n(C)c2C)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.92,-.52,;-4.59,-1.29,;-3.25,-.52,;-2.85,.97,;-1.37,.57,;-.03,1.34,;1.3,.57,;2.63,-.2,;.53,-.76,;2.07,1.91,;1.3,3.24,;2.07,4.57,;3.61,4.57,;4.38,5.91,;4.38,3.24,;5.92,3.24,;3.61,1.91,;4.38,.57,;-1.77,-.92,;-4.59,-2.83,;-5.92,-3.6,;-5.92,-5.14,;-4.59,-5.91,;-3.25,-5.14,;-1.79,-5.61,;-.88,-4.37,;-1.79,-3.12,;-3.25,-3.6,)|

BDBM489985

CN([C@@H]1C[C@H](CS(=O)(=O)C2CC(F)(F)C2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.99,1.48,;-4.66,.71,;-3.32,1.48,;-2.92,2.97,;-1.44,2.57,;-.1,3.34,;1.23,2.57,;2,3.91,;.46,1.24,;2.56,1.8,;2.96,.32,;4.45,.71,;5.99,.71,;5.22,-.62,;4.05,2.2,;-1.84,1.09,;-4.66,-.83,;-5.99,-1.6,;-5.99,-3.14,;-4.66,-3.91,;-3.32,-3.14,;-1.86,-3.61,;-.95,-2.37,;-1.86,-1.12,;-3.32,-1.6,)|

BDBM489986

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccc(=O)n(C)c2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.92,-.52,;-4.59,-1.29,;-3.25,-.52,;-2.85,.97,;-1.37,.57,;-.03,1.34,;1.3,.57,;2.63,-.2,;.53,-.76,;2.07,1.91,;1.3,3.24,;2.07,4.57,;3.61,4.57,;4.38,5.91,;4.38,3.24,;5.92,3.24,;3.61,1.91,;-1.77,-.92,;-4.59,-2.83,;-5.92,-3.6,;-5.92,-5.14,;-4.59,-5.91,;-3.25,-5.14,;-1.79,-5.61,;-.88,-4.37,;-1.79,-3.12,;-3.25,-3.6,)|

BDBM489987

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccc(F)cc2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.24,.28,;-4.91,-.49,;-3.82,.6,;-3.82,2.14,;-2.28,2.14,;-1.19,3.23,;.29,2.83,;.69,4.31,;-.1,1.34,;1.78,3.23,;2.18,4.71,;3.67,5.11,;4.76,4.02,;6.24,4.42,;4.36,2.54,;2.87,2.14,;-2.28,.6,;-4.91,-2.03,;-6.24,-2.8,;-6.24,-4.34,;-4.91,-5.11,;-3.58,-4.34,;-2.11,-4.82,;-1.21,-3.57,;-2.11,-2.33,;-3.58,-2.8,)|

BDBM489988

CC(C)Oc1cccc(c1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:16.19,14.14,(6.44,3.33,;6.05,1.85,;7.13,.76,;4.56,1.45,;3.47,2.54,;3.87,4.02,;2.78,5.11,;1.29,4.71,;.89,3.23,;1.98,2.14,;-.6,2.83,;-.2,4.31,;-.99,1.34,;-2.08,3.23,;-3.17,2.14,;-4.71,2.14,;-4.71,.6,;-3.17,.6,;-5.8,-.49,;-7.13,.28,;-5.8,-2.03,;-7.13,-2.8,;-7.13,-4.34,;-5.8,-5.11,;-4.47,-4.34,;-3,-4.82,;-2.1,-3.57,;-3,-2.33,;-4.47,-2.8,)|

BDBM489989

COC[C@H]1CC[C@@H](CC1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:3.2,wD:15.18,13.13,6.9,(4.81,-4.74,;4.04,-3.41,;4.81,-2.08,;4.04,-.74,;2.5,-.74,;1.73,.59,;2.5,1.92,;4.04,1.92,;4.81,.59,;1.73,3.26,;1.33,4.74,;2.82,4.35,;.24,3.66,;-.85,2.57,;-2.39,2.57,;-2.39,1.03,;-.85,1.03,;-3.48,-.06,;-4.81,.71,;-3.48,-1.6,;-4.81,-2.37,;-4.81,-3.91,;-3.48,-4.68,;-2.14,-3.91,;-.68,-4.39,;.23,-3.14,;-.68,-1.9,;-2.14,-2.37,)|

BDBM489990

COc1ccc(Cl)c(c1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:15.18,13.13,(6.94,1.8,;5.61,2.57,;4.28,1.8,;4.28,.26,;2.94,-.51,;1.61,.26,;.28,-.51,;1.61,1.8,;2.94,2.57,;.28,2.57,;-.49,1.24,;1.05,3.91,;-1.06,3.34,;-2.39,2.57,;-3.88,2.97,;-4.28,1.48,;-2.79,1.09,;-5.61,.71,;-6.94,1.48,;-5.61,-.83,;-6.94,-1.6,;-6.94,-3.14,;-5.61,-3.91,;-4.28,-3.14,;-2.81,-3.61,;-1.91,-2.37,;-2.81,-1.12,;-4.28,-1.6,)|

BDBM489991

CN([C@@H]1C[C@H](CS(=O)(=O)CC2CCC(F)(F)CC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.59,1.41,;-4.26,.64,;-2.92,1.41,;-2.52,2.89,;-1.04,2.5,;.3,3.27,;1.63,2.5,;3.12,2.89,;2.03,3.98,;1.23,1.01,;2.32,-.08,;1.92,-1.57,;3.01,-2.66,;4.5,-2.26,;5.59,-3.35,;4.5,-3.8,;4.9,-.77,;3.81,.32,;-1.43,1.01,;-4.26,-.9,;-5.59,-1.67,;-5.59,-3.21,;-4.26,-3.98,;-2.92,-3.21,;-1.46,-3.69,;-.55,-2.44,;-1.46,-1.2,;-2.92,-1.67,)|

BDBM489992

CN([C@@H]1C[C@H](CS(=O)(=O)CCC(C)(F)F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.28,1.48,;-4.95,.71,;-3.61,1.48,;-3.21,2.97,;-1.73,2.57,;-.39,3.34,;.94,2.57,;1.71,3.91,;1.71,1.24,;2.48,2.57,;3.25,1.24,;4.79,1.24,;6.28,1.64,;5.56,-.09,;5.56,2.57,;-2.12,1.09,;-4.95,-.83,;-6.28,-1.6,;-6.28,-3.14,;-4.95,-3.91,;-3.61,-3.14,;-2.15,-3.61,;-1.24,-2.37,;-2.15,-1.12,;-3.61,-1.6,)|

BDBM489993

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccc(c(F)c2)C(F)(F)F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.91,-.15,;-5.58,-.92,;-4.49,.17,;-4.49,1.71,;-2.95,1.71,;-1.86,2.8,;-.37,2.4,;.03,3.89,;-.77,.92,;1.12,2.8,;1.51,4.29,;3,4.69,;4.09,3.6,;3.69,2.11,;4.78,1.02,;2.2,1.71,;5.58,4,;6.67,2.91,;6.91,4.77,;5.58,5.54,;-2.95,.17,;-5.58,-2.46,;-6.91,-3.23,;-6.91,-4.77,;-5.58,-5.54,;-4.24,-4.77,;-2.78,-5.24,;-1.87,-4,;-2.78,-2.75,;-4.24,-3.23,)|

BDBM489994

CC[C@H](C)CS(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:2.2,wD:11.13,9.8,(3.9,-2.66,;2.81,-1.57,;3.21,-.08,;4.7,.32,;2.12,1.01,;2.52,2.5,;4.01,2.89,;2.92,3.98,;1.19,3.27,;-.15,2.5,;-1.63,2.89,;-2.03,1.41,;-.54,1.01,;-3.37,.64,;-4.7,1.41,;-3.37,-.9,;-4.7,-1.67,;-4.7,-3.21,;-3.37,-3.98,;-2.03,-3.21,;-.57,-3.69,;.34,-2.44,;-.57,-1.2,;-2.03,-1.67,)|

BDBM489995

COCc1cccc(c1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:15.18,13.13,(6.44,4.97,;5.35,6.06,;3.87,5.66,;3.47,4.17,;4.56,3.08,;4.16,1.59,;2.67,1.19,;1.58,2.28,;1.98,3.77,;.1,1.88,;.49,3.37,;-.3,.4,;-1.39,2.28,;-2.48,1.19,;-4.02,1.19,;-4.02,-.35,;-2.48,-.35,;-5.11,-1.44,;-6.44,-.67,;-5.11,-2.98,;-6.44,-3.75,;-6.44,-5.29,;-5.11,-6.06,;-3.78,-5.29,;-2.31,-5.76,;-1.41,-4.52,;-2.31,-3.27,;-3.78,-3.75,)|

BDBM489996

CN([C@@H]1C[C@H](CS(=O)(=O)c2cnc(C)s2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-3.07,-1.66,;-1.74,-2.43,;-.65,-1.34,;-.65,.2,;.89,.2,;1.98,1.29,;1.58,2.78,;3.07,3.17,;.1,2.38,;1.18,4.26,;2.09,5.51,;1.18,6.76,;-.28,6.28,;-1.61,7.05,;-.28,4.74,;.89,-1.34,;-1.74,-3.97,;-3.07,-4.74,;-3.07,-6.28,;-1.74,-7.05,;-.4,-6.28,;1.06,-6.76,;1.97,-5.51,;1.06,-4.26,;-.4,-4.74,)|

BDBM489997

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccncc2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-5.5,.28,;-4.17,-.49,;-3.08,.6,;-3.08,2.14,;-1.54,2.14,;-.45,3.23,;1.04,2.83,;1.44,4.31,;.64,1.34,;2.53,3.23,;3.61,2.14,;5.1,2.54,;5.5,4.02,;4.41,5.11,;2.92,4.71,;-1.54,.6,;-4.17,-2.03,;-5.5,-2.8,;-5.5,-4.34,;-4.17,-5.11,;-2.83,-4.34,;-1.37,-4.82,;-.46,-3.57,;-1.37,-2.33,;-2.83,-2.8,)|

BDBM489998

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccc(Cl)cc2F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-6.24,-.07,;-4.91,-.84,;-3.82,.25,;-3.82,1.79,;-2.28,1.79,;-1.19,2.88,;.29,2.48,;.69,3.97,;-.1,.99,;1.78,2.88,;2.87,1.79,;4.36,2.19,;4.76,3.68,;6.24,4.08,;3.67,4.77,;2.18,4.37,;1.09,5.46,;-2.28,.25,;-4.91,-2.38,;-6.24,-3.15,;-6.24,-4.69,;-4.91,-5.46,;-3.58,-4.69,;-2.11,-5.16,;-1.21,-3.92,;-2.11,-2.67,;-3.58,-3.15,)|

BDBM489999

CN([C@@H]1C[C@H](CS(=O)(=O)c2ccc(nc2)C(F)(F)F)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-4.28,1.61,;-2.94,.84,;-1.61,1.61,;-1.21,3.09,;.28,2.7,;1.61,3.47,;2.94,2.7,;4.28,3.47,;2.94,4.24,;2.94,1.15,;1.61,.38,;1.61,-1.16,;2.94,-1.93,;4.28,-1.15,;4.28,.39,;2.94,-3.47,;4.28,-4.24,;1.61,-4.24,;1.61,-2.7,;-.12,1.21,;-2.94,-.7,;-4.28,-1.47,;-4.28,-3.01,;-2.94,-3.78,;-1.61,-3.01,;-.15,-3.49,;.76,-2.24,;-.15,-1,;-1.61,-1.47,)|

BDBM490000

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCC(CF)CC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(-4.28,1.61,;-2.94,.84,;-1.61,1.61,;-1.21,3.09,;.28,2.69,;1.61,3.47,;2.94,2.69,;4.28,3.47,;2.94,4.23,;2.94,1.15,;1.61,.38,;1.61,-1.15,;2.94,-1.93,;2.94,-3.46,;4.28,-4.23,;4.28,-1.15,;4.28,.38,;-.12,1.21,;-2.94,-.7,;-4.28,-1.47,;-4.28,-3.01,;-2.94,-3.78,;-1.61,-3.01,;-.15,-3.49,;.76,-2.24,;-.15,-1,;-1.61,-1.47,)|

BDBM490001

CO[C@H](C)C1CCN(CC1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:16.19,14.14,2.2,(4.28,-5.01,;4.28,-3.47,;2.94,-2.7,;1.61,-3.47,;2.94,-1.16,;4.28,-.38,;4.28,1.16,;2.94,1.92,;1.61,1.15,;1.61,-.39,;2.94,3.47,;4.28,4.24,;2.94,5.01,;1.61,4.24,;.28,3.47,;-1.21,3.86,;-1.61,2.38,;-.12,1.98,;-2.94,1.61,;-4.28,2.38,;-2.94,.07,;-4.28,-.7,;-4.28,-2.24,;-2.94,-3.01,;-1.61,-2.24,;-.15,-2.72,;.76,-1.47,;-.15,-.23,;-1.61,-.7,)|

BDBM490002

COc1ccc2CN(CCc2n1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:18.22,16.17,(-8.8,-2.05,;-8.8,-.51,;-7.46,.26,;-7.46,1.8,;-6.13,2.57,;-4.8,1.8,;-3.46,2.57,;-2.13,1.8,;-2.13,.26,;-3.46,-.51,;-4.8,.26,;-6.13,-.51,;-.79,2.57,;-.02,1.24,;-1.56,3.91,;.54,3.34,;1.87,2.57,;3.36,2.97,;3.76,1.48,;2.27,1.09,;5.09,.71,;6.43,1.48,;5.09,-.83,;3.76,-1.6,;3.76,-3.14,;5.09,-3.91,;6.43,-3.14,;7.89,-3.61,;8.8,-2.37,;7.89,-1.12,;6.43,-1.6,)|

BDBM490003

CN([C@@H]1C[C@H](CS(=O)(=O)N2Cc3cn(C)nc3C(C)(C)C2)C1)c1ncnc2[nH]ccc12 |r,wU:2.1,4.4,(4.45,4.1,;3.68,2.77,;2.14,2.77,;1.05,3.86,;-.04,2.77,;-1.58,2.77,;-2.35,1.44,;-1.01,.67,;-3.68,2.21,;-3.12,.1,;-4.66,.1,;-5.43,-1.23,;-6.93,-1.55,;-7.09,-3.08,;-8.43,-3.85,;-5.69,-3.71,;-4.66,-2.56,;-3.12,-2.56,;-3.12,-4.1,;-1.78,-3.33,;-2.35,-1.23,;1.05,1.68,;4.45,1.44,;3.68,.1,;4.45,-1.23,;5.99,-1.23,;6.76,.1,;8.27,.42,;8.43,1.95,;7.02,2.58,;5.99,1.44,)|

BDBM490004

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCn3cncc3C2)C1)c1ncnc2[nH]ccc12 |r,wU:2.1,4.4,(2.95,4.52,;2.18,3.19,;.64,3.19,;-.45,4.27,;-1.54,3.19,;-3.08,3.19,;-3.85,1.85,;-2.51,1.08,;-5.18,2.62,;-4.62,.52,;-6.16,.52,;-6.93,-.82,;-6.16,-2.15,;-6.63,-3.61,;-5.39,-4.52,;-4.14,-3.61,;-4.62,-2.15,;-3.85,-.82,;-.45,2.1,;2.95,1.85,;2.18,.52,;2.95,-.82,;4.49,-.82,;5.26,.52,;6.77,.84,;6.93,2.37,;5.52,3,;4.49,1.85,)|

BDBM490005

CN([C@@H]1C[C@H](CS(=O)(=O)N2Cc3cnn(C)c3C2)C1)c1ncnc2[nH]ccc12 |r,wU:2.1,4.4,(3.44,4.61,;2.67,3.27,;1.13,3.27,;.04,4.36,;-1.05,3.27,;-2.59,3.27,;-3.36,1.94,;-2.03,1.17,;-4.7,2.71,;-4.13,.6,;-5.67,.6,;-6.15,-.88,;-7.41,-1.79,;-6.93,-3.27,;-5.38,-3.27,;-4.61,-4.61,;-4.89,-1.79,;-3.63,-.88,;.04,2.18,;3.44,1.94,;2.67,.6,;3.44,-.73,;4.98,-.73,;5.75,.6,;7.25,.92,;7.41,2.46,;6.01,3.08,;4.98,1.94,)|

BDBM490006

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCCC(C2)C(F)(F)F)C1)c1ncnc2[nH]ccc12 |r,wU:2.1,4.4,(2.95,4.68,;2.18,3.35,;.64,3.35,;-.44,4.44,;-1.53,3.35,;-3.07,3.35,;-3.84,2.02,;-2.51,1.25,;-5.18,2.79,;-4.61,.68,;-6.15,.68,;-6.93,-.67,;-6.15,-2.02,;-4.6,-2.02,;-3.82,-.67,;-3.83,-3.35,;-3.06,-4.68,;-2.49,-2.58,;-5.16,-4.12,;-.44,2.26,;2.95,2.02,;2.18,.68,;2.95,-.65,;4.49,-.65,;5.26,.68,;6.77,1,;6.93,2.53,;5.52,3.16,;4.49,2.02,)|

BDBM490007

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCc3c(C2)c(C)nn3C)C1)c1ncnc2[nH]ccc12 |r,wU:2.1,4.4,(3.47,4.55,;2.7,3.21,;1.16,3.21,;.07,4.3,;-1.02,3.21,;-2.56,3.21,;-3.33,1.88,;-1.99,1.11,;-4.66,2.65,;-4.1,.55,;-5.64,.55,;-6.41,-.8,;-5.64,-2.15,;-4.08,-2.15,;-3.3,-.8,;-3.6,-3.63,;-2.26,-4.4,;-4.86,-4.55,;-6.12,-3.63,;-7.45,-4.4,;.07,2.12,;3.47,1.88,;2.7,.55,;3.47,-.79,;5.01,-.79,;5.78,.55,;7.29,.87,;7.45,2.4,;6.04,3.02,;5.01,1.88,)|

BDBM490008

COc1ccc2CN(Cc2c1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:17.21,15.16,(-8.03,-5.14,;-8.03,-3.6,;-6.7,-2.83,;-5.36,-3.6,;-4.03,-2.83,;-4.03,-1.29,;-2.89,-.26,;-3.51,1.14,;-5.04,.98,;-5.36,-.52,;-6.7,-1.29,;-2.74,2.48,;-1.41,1.71,;-4.08,3.25,;-1.97,3.81,;-.43,3.81,;.66,4.9,;1.74,3.81,;.66,2.72,;3.28,3.81,;4.05,5.14,;4.05,2.48,;3.28,1.14,;4.05,-.19,;5.59,-.19,;6.36,1.14,;7.87,1.46,;8.03,2.99,;6.63,3.62,;5.59,2.48,)|

BDBM490009

CN([C@@H]1C[C@H](CS(=O)(=O)N2Cc3ccccc3C(F)(F)C2)C1)c1ncnc2[nH]ccc12 |r,wU:2.1,4.4,(4.11,4.1,;3.34,2.77,;1.8,2.77,;.71,3.86,;-.38,2.77,;-1.92,2.77,;-2.69,1.44,;-1.36,.67,;-4.03,2.21,;-3.46,.1,;-5,.1,;-5.77,-1.23,;-7.31,-1.23,;-8.08,-2.56,;-7.31,-3.9,;-5.77,-3.9,;-5,-2.56,;-3.46,-2.56,;-3.46,-4.1,;-2.13,-3.33,;-2.69,-1.23,;.71,1.68,;4.11,1.44,;3.34,.1,;4.11,-1.23,;5.65,-1.23,;6.42,.1,;7.92,.42,;8.08,1.95,;6.68,2.58,;5.65,1.44,)|

BDBM490010

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCc3ccccc3C2)C1)c1ncnc2[nH]ccc12 |r,wU:2.1,4.4,(4.11,4,;3.34,2.67,;1.8,2.67,;.71,3.76,;-.38,2.67,;-1.92,2.67,;-2.69,1.33,;-1.36,.56,;-4.03,2.1,;-3.46,,;-2.69,-1.33,;-3.46,-2.67,;-5,-2.67,;-5.77,-4,;-7.31,-4,;-8.08,-2.67,;-7.31,-1.33,;-5.77,-1.33,;-5,,;.71,1.58,;4.11,1.33,;3.34,,;4.11,-1.33,;5.65,-1.33,;6.42,,;7.92,.32,;8.08,1.85,;6.68,2.48,;5.65,1.33,)|

BDBM490011

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCn3cccc3C2)C1)c1ncnc2[nH]ccc12 |r,wU:2.1,4.4,(2.95,4.52,;2.18,3.19,;.64,3.19,;-.45,4.27,;-1.54,3.19,;-3.08,3.19,;-3.85,1.85,;-2.51,1.08,;-5.18,2.62,;-4.62,.52,;-6.16,.52,;-6.93,-.82,;-6.16,-2.15,;-6.63,-3.61,;-5.39,-4.52,;-4.14,-3.61,;-4.62,-2.15,;-3.85,-.82,;-.45,2.1,;2.95,1.85,;2.18,.52,;2.95,-.82,;4.49,-.82,;5.26,.52,;6.77,.84,;6.93,2.37,;5.52,3,;4.49,1.85,)|

BDBM490631

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc3CCNc3c2)n1

BDBM490632

CC1(C)CNc2cc(Nc3nc(nc4CNC(=O)c34)-c3c(F)cccc3F)ccc12

BDBM490676

CC1(C)Cc2ccc(Nc3nc(nc4CNC(=O)c34)-c3c(F)cccc3F)cc2N1

BDBM490677

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2C[C@@H]3CC[C@H](C2)O3)c2C(=O)NCc2n1 |r|

BDBM490678

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)C(=O)N2CC3CCC(C2)O3)n1

BDBM490679

CC(O)(C(O)=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM490680

C[C@@](O)(C(O)=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM490681

C[C@](O)(C(O)=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM490682

CCNC(=O)C(C)(N)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM490683

CC1(C)CNc2nc(Nc3cc(nc4CNC(=O)c34)-c3c(F)cccc3F)ccc12

BDBM490684

OCC(CO)Oc1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM490685

COc1ccc(CNc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM490686

CCNC(=O)C(C)(O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM490687

CCNC(=O)[C@@](C)(O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM490688

CCNC(=O)[C@](C)(O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM490689

Fc1cccc(F)c1-c1cc(Nc2cc3NCCc3cn2)c2C(=O)NCc2n1

BDBM490690

Fc1cccc(F)c1-c1cc(Nc2ccc3OCCCNc3n2)c2C(=O)NCc2n1

BDBM490691

Nc1ccc2ccn(-c3cc(nc4CNC(=O)c34)-c3c(F)cccc3F)c2n1

BDBM490692

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CCC3(CC3)CC2)c2C(=O)NCc2n1

BDBM490693

Fc1cccc(F)c1-c1cc(Nc2ccc3cc[nH]c3n2)c2C(=O)NCc2n1

BDBM490694

Fc1cccc(F)c1-c1cc(Nc2ccc3CCNc3n2)c2C(=O)NCc2n1

BDBM490695

CC1(C)COc2cc(Nc3nc(nc4CNC(=O)c34)-c3c(F)cccc3F)ccc12

BDBM490696

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CCC3(COC3)CC2)c2C(=O)NCc2n1

BDBM490697

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CCC3(CCO3)CC2)c2C(=O)NCc2n1

BDBM490698

CCNC(=O)C(O)(CC(F)(F)F)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM490699

CCNC(=O)[C@](O)(CC(F)(F)F)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM490700

CCNC(=O)[C@@](O)(CC(F)(F)F)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM490701

OC(c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1)C(F)(F)F

BDBM490702

O[C@@H](c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1)C(F)(F)F |r|

BDBM490703

O[C@H](c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1)C(F)(F)F |r|

BDBM490704

CC(N)(C(O)=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM490705

CC(O)(c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1)C(F)(F)F

BDBM490706

C[C@](O)(c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1)C(F)(F)F |r|

BDBM490707

C[C@@](O)(c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1)C(F)(F)F |r|

BDBM490708

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CCCC3(CCO3)C2)c2C(=O)NCc2n1

BDBM490709

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CCC[C@@]3(CCO3)C2)c2C(=O)NCc2n1 |r|

BDBM490710

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CCC[C@]3(CCO3)C2)c2C(=O)NCc2n1 |r|

BDBM490711

CN1C(=O)C(C)(Oc2ccccc12)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM490712

CN1C(=O)[C@@](C)(Oc2ccccc12)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM490713

CN1C(=O)[C@](C)(Oc2ccccc12)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM490714

CC(O)(c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1)C(F)(F)F

BDBM490715

C[C@](O)(c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1)C(F)(F)F |r|

BDBM490716

C[C@@](O)(c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1)C(F)(F)F |r|

BDBM490717

C[C@@](N)(C(O)=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM490718

C[C@](N)(C(O)=O)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM490719

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CCOCC22CC2)c2C(=O)NCc2n1

BDBM490720

CN1C(=O)C(C)(c2ccccc12)c1ccc(Nc2nc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM490721

Fc1cccc(F)c1-c1cc(Nc2ccc(cc2)C(=O)N2CCOC3(CC3)C2)c2C(=O)NCc2n1

BDBM490722

Fc1cccc(F)c1-c1cc(Nc2ccc(cc2)C(=O)N2CCOCC22CC2)c2C(=O)NCc2n1

BDBM490723

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CCC3(CCOC3)CC2)c2C(=O)NCc2n1

BDBM490724

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CCC3(CCCCO3)CC2)c2C(=O)NCc2n1

BDBM490725

Fc1cccc(F)c1-c1cc(Nc2ccc(cc2)C(=O)N2CCC3(CCCCO3)CC2)c2C(=O)NCc2n1

BDBM490726

CC1(C)CC(C)(C(=O)N1C1=CCOCC1)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1 |t:10|

BDBM490727

Fc1cccc(=O)n1-c1cc(Nc2ccc(cn2)N2CCOCC2)c2C(=O)NCc2n1

BDBM490728

Fc1cccc(F)c1-c1cc(Nc2ccc(cc2)C(=O)N2CCC3(CC3)CC2)c2C(=O)NCc2n1

BDBM490729

Fc1cccc(F)c1-c1cc(Nc2ccc(cc2)C(=O)N2CCC3(CCOCC3)CC2)c2C(=O)NCc2n1

BDBM490731

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)C2C[C@@H]3COC[C@@H]3C2)c2C(=O)NCc2n1 |r|

BDBM490732

Fc1cc(cc(F)c1-c1cc(Nc2ccc(cn2)N2CCC3(CC3)CC2)c2C(=O)NCc2n1)C#N

BDBM490733

OB1OCc2cc(Nc3cc(nc4CNC(=O)c34)-c3c(F)cccc3F)ccc12

BDBM490734

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CCC3(CC2)OCCO3)c2C(=O)NCc2n1

BDBM490736

CN1CCc2cc(Nc3cc(nc4CNC(=O)c34)-c3c(F)cccc3F)ccc2C1=O

BDBM490737

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)N2CCOC22COC2)c2C(=O)NCc2n1

BDBM490738

OC(c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1)(C(F)(F)F)C(F)(F)F

BDBM490739

CCNC(=O)C(C)(C)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1

BDBM490740

Fc1cccc(F)c1-c1cc(Nc2ccc3OCOc3c2)c2C(=O)NCc2n1

BDBM490741

Fc1cccc(F)c1-c1cc(Nc2ccc3OC(F)(F)Oc3c2)c2C(=O)NCc2n1

BDBM490742

CC1(C)COc2cc(Nc3cc(nc4CNC(=O)c34)-c3c(F)cccc3F)ccc12

BDBM490743

CC1(C)Cc2ccc(Nc3cc(nc4CNC(=O)c34)-c3c(F)cccc3F)cc2O1

BDBM490744

Fc1cccc(F)c1-c1cc(Nc2ccc3C(=O)CCOc3c2)c2C(=O)NCc2n1

BDBM490745

Fc1cccc(F)c1-c1cc(Nc2ccc(nc2)N2C[C@@H]3COC[C@@H]3C2)c2C(=O)NCc2n1 |r|

BDBM490746

Fc1cccc(C#N)c1-c1cc(Nc2ccc(nc2)N2C[C@@H]3COC[C@@H]3C2)c2C(=O)NCc2n1 |r|

BDBM490747

Fc1cccc(C#N)c1-c1cc(Nc2ccc(nc2)N2CCC3(CC3)CC2)c2C(=O)NCc2n1

BDBM490748

Fc1cccc(C#N)c1-c1cc(Nc2ccc(cn2)N2C[C@@H]3COC[C@@H]3C2)c2C(=O)NCc2n1 |r|

BDBM490749

Fc1cccc(F)c1-c1cc(Nc2ccc3C(=O)C4(CC4)Oc3c2)c2C(=O)NCc2n1

BDBM490750

CC(O)(c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1)C(F)(F)F

BDBM490751

Fc1cccc(C#N)c1-c1cc(Nc2ccc(nc2)N2CCOC3(CC3)C2)c2C(=O)NCc2n1

BDBM490752

CC1(C)COc2cc(Nc3cc(nc4CNC(=O)c34)-c3c(F)cccc3C#N)ccc12

BDBM490753

CCNC(=O)C(C)(C)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2C#N)cc1

BDBM490754

C[C@](O)(c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1)C(F)(F)F |r|

BDBM490755

C[C@@](O)(c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)nc1)C(F)(F)F |r|

BDBM490756

[O-][n+]1c2CNC(=O)c2c(Nc2ccc(cc2)C(=O)N2CCOCC2)cc1-c1c(F)cccc1F |(7.34,-.53,;6,.24,;6,1.78,;7.15,2.81,;6.52,4.22,;4.99,4.06,;3.9,5.15,;4.67,2.55,;3.33,1.78,;2,2.55,;.67,1.78,;-.67,2.55,;-2,1.78,;-2,.24,;-.67,-.53,;.67,.24,;-3.33,-.53,;-3.33,-2.07,;-4.67,.24,;-4.67,1.78,;-6,2.55,;-7.34,1.78,;-7.34,.24,;-6,-.53,;3.33,.24,;4.67,-.53,;4.67,-2.07,;3.33,-2.84,;2,-2.07,;3.33,-4.38,;4.67,-5.15,;6,-4.38,;6,-2.84,;7.34,-2.07,)|

BDBM490757

CC1(C)COc2nc(Nc3cc(nc4CNC(=O)c34)-c3c(F)cccc3C#N)ccc12

BDBM490758

Fc1cccc(F)c1-c1cc(Nc2ccc3CS(=O)(=O)Cc3c2)c2C(=O)NCc2n1

BDBM490759

OC1C2(CC2)CN(CC11CC1)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2C#N)nc1

BDBM490760

OC1CO[C@]2(CCN(C2)c2ccc(Nc3cc(nc4CNC(=O)c34)-c3c(F)cccc3C#N)nc2)C1 |r,w:1.0|

BDBM490761

OC1CO[C@@]2(CCN(C2)c2ccc(Nc3cc(nc4CNC(=O)c34)-c3c(F)cccc3C#N)nc2)C1 |r,w:1.0|

BDBM490762

O[C@H]1CO[C@]2(CCN(C2)c2ccc(Nc3cc(nc4CNC(=O)c34)-c3c(F)cccc3C#N)nc2)C1 |r|

BDBM490763

O[C@@H]1CO[C@]2(CCN(C2)c2ccc(Nc3cc(nc4CNC(=O)c34)-c3c(F)cccc3C#N)nc2)C1 |r|

BDBM490764

O[C@H]1CO[C@@]2(CCN(C2)c2ccc(Nc3cc(nc4CNC(=O)c34)-c3c(F)cccc3C#N)nc2)C1 |r|

BDBM490765

O[C@@H]1CO[C@@]2(CCN(C2)c2ccc(Nc3cc(nc4CNC(=O)c34)-c3c(F)cccc3C#N)nc2)C1 |r|

BDBM492755

CNC(=O)c1ccc(Nc2nccc(n2)N2C[C@@H]3CC[C@H](C2)N3CC2CC2(F)F)cc1C |r,THB:23:22:21.15.16:19.18|

BDBM492762

CCOC(=O)N1[C@H]2CC[C@@H]1CN(C2)c1ccnc(Nc2cnsc2)n1 |r,THB:3:5:10.11.12:8.7|

BDBM502821

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@H]1CC[C@H](O)CC1 |r,wU:24.27,wD:27.31,(-1.81,6.37,;-2.71,5.12,;-2.09,3.72,;-.56,3.56,;.35,4.8,;-2.99,2.47,;-2.52,1.01,;-3.76,.1,;-5.01,1.01,;-4.53,2.47,;-3.76,-1.44,;-2.43,-2.21,;-2.43,-3.75,;-3.76,-4.52,;-5.1,-3.75,;-6.56,-4.22,;-7.47,-2.98,;-6.56,-1.73,;-5.1,-2.21,;-1.1,-4.52,;-.94,-6.05,;.57,-6.37,;1.34,-5.04,;.31,-3.89,;2.87,-4.88,;3.5,-3.47,;5.03,-3.31,;5.94,-4.55,;7.47,-4.39,;5.31,-5.96,;3.78,-6.12,)|

BDBM502825

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@@H]1CC[C@H](O)CC1 |r,wU:24.27,27.31,(-1.81,6.37,;-2.71,5.12,;-2.09,3.72,;-.56,3.56,;.35,4.8,;-2.99,2.47,;-2.52,1.01,;-3.76,.1,;-5.01,1.01,;-4.53,2.47,;-3.76,-1.44,;-2.43,-2.21,;-2.43,-3.75,;-3.76,-4.52,;-5.1,-3.75,;-6.56,-4.22,;-7.47,-2.98,;-6.56,-1.73,;-5.1,-2.21,;-1.1,-4.52,;-.94,-6.05,;.57,-6.37,;1.34,-5.04,;.31,-3.89,;2.87,-4.88,;3.78,-6.12,;5.31,-5.96,;5.94,-4.55,;7.47,-4.39,;5.03,-3.31,;3.5,-3.47,)|

BDBM502826

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H]2C[C@H](CO)C2)c1 |r,wU:26.29,24.26,(-7.55,12.73,;-6.92,14.14,;-5.39,14.3,;-4.76,15.71,;-3.23,15.87,;-4.48,13.06,;-4.96,11.59,;-3.71,10.69,;-2.47,11.59,;-2.94,13.06,;-3.71,9.15,;-2.38,8.38,;-2.38,6.84,;-3.71,6.07,;-5.05,6.84,;-6.51,6.36,;-7.42,7.61,;-6.51,8.85,;-5.05,8.38,;-1.05,6.07,;-.88,4.53,;.62,4.21,;1.39,5.55,;2.92,5.71,;3.83,4.46,;3.59,2.94,;5.11,2.7,;6.01,1.46,;7.55,1.62,;5.35,4.22,;.36,6.69,)|

BDBM502873

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@H]1C[C@@](C)(O)C1 |r,wU:24.27,26.31,wD:26.30,(.5,8.74,;-.41,7.49,;.22,6.08,;1.75,5.92,;2.66,7.17,;-.69,4.84,;-.21,3.37,;-1.46,2.47,;-2.7,3.37,;-2.23,4.84,;-1.46,.93,;-.12,.16,;-.12,-1.38,;-1.46,-2.15,;-2.79,-1.38,;-4.26,-1.86,;-5.16,-.61,;-4.26,.63,;-2.79,.16,;1.21,-2.15,;2.62,-1.53,;3.65,-2.67,;2.88,-4.01,;1.37,-3.68,;3.5,-5.41,;4.94,-5.96,;4.39,-7.4,;3.62,-8.74,;5.16,-8.74,;2.95,-6.85,)|

BDBM502874

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@H]1C[C@](O)(CO)C1 |r,wU:24.27,26.30,wD:26.31,(-.25,19.36,;-1.15,18.12,;-.53,16.71,;1.01,16.55,;1.91,17.79,;-1.43,15.46,;-.95,14,;-2.2,13.09,;-3.45,14,;-2.97,15.46,;-2.2,11.55,;-.87,10.78,;-.87,9.24,;-2.2,8.47,;-3.53,9.24,;-5,8.77,;-5.9,10.01,;-5,11.26,;-3.53,10.78,;.47,8.47,;1.87,9.1,;2.9,7.96,;2.13,6.62,;.63,6.94,;2.76,5.22,;4.2,4.66,;3.65,3.23,;5.19,3.23,;4.42,1.89,;5.9,1.49,;2.21,3.78,)|

BDBM502876

CCC(CC)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(c1)[C@H]1C[C@H](CO)C1 |r,wU:26.30,wD:24.27,(-7.02,-8.06,;-6.11,-6.82,;-4.58,-6.98,;-3.95,-8.39,;-4.86,-9.63,;-3.67,-5.73,;-4.15,-4.27,;-2.9,-3.36,;-1.66,-4.27,;-2.13,-5.73,;-2.9,-1.82,;-1.57,-1.05,;-1.57,.49,;-2.9,1.26,;-4.24,.49,;-5.7,.96,;-6.61,-.28,;-5.7,-1.53,;-4.24,-1.05,;-.24,1.26,;-.08,2.79,;1.43,3.11,;2.2,1.77,;1.17,.63,;3.73,1.61,;4.7,.42,;5.9,1.39,;7.43,1.22,;8.06,-.18,;4.93,2.58,)|

BDBM502906

C[C@@H](CC(F)(F)F)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM502910

CC[C@H](n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1)C(C)(F)F |r|

BDBM502917

CC[C@@H](CC1CC1)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM502930

C[C@@H]1CC[C@@H]1n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C[C@@H](O)CO)c1 |r|

BDBM506363

CCS(=O)(=O)N1CC(CC#N)(C1)n1cc(cn1)-c1c(cnc2[nH]ccc12)C#N

BDBM506374

CCS(=O)(=O)N1CC(CC#N)(C1)n1cc(cn1)-c1ccnc2[nH]ccc12

BDBM506379

CC(C)CS(=O)(=O)N1CC(CC#N)(C1)n1cc(cn1)-c1ccnc2[nH]ccc12

BDBM506381

FC(F)(F)CCS(=O)(=O)N1CC(CC#N)(C1)n1cc(cn1)-c1ccnc2[nH]ccc12

BDBM506385

CCS(=O)(=O)N1CC(C1)(C(C)C#N)n1cc(cn1)-c1ncnc2[nH]ccc12

BDBM506386

CC(C)S(=O)(=O)N1CC(CC#N)(C1)n1cc(cn1)-c1c(cnc2[nH]ccc12)C#N

BDBM506389

CCS(=O)(=O)N1CC(CC#N)(C1)n1cc(c(C)n1)-c1ccnc2[nH]ccc12

BDBM506390

O=S(=O)(N1CC(CC#N)(C1)n1cc(cn1)-c1ccnc2[nH]ccc12)N1CCCC1

BDBM506388

CCS(=O)(=O)N1CC(C1)(C(C)C#N)n1cc(cn1)-c1c(cnc2[nH]ccc12)C#N

BDBM511480

CC1(C)O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)COC(=O)CCC(=O)OCc1ccc(cc1)[C@@H](CN)C(=O)Nc1ccc2cnccc2c1 |r,c:15,t:11|

BDBM511481

C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COC(=O)CCC(=O)OCc1ccc(cc1)[C@@H](CN)C(=O)Nc1ccc2cnccc2c1 |r,c:11,t:7|

BDBM511482

C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COC(=O)C[C@H](N)C(=O)OCc1ccc(cc1)[C@@H](CN)C(=O)Nc1ccc2cnccc2c1 |r,c:11,t:7|

BDBM511483

C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COC(=O)c1ccc(cc1)C(=O)OCc1ccc(cc1)[C@@H](CN)C(=O)Nc1ccc2cnccc2c1 |r,c:11,t:7|

BDBM511484

CC1(C)O[C@@H]2C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)COC(=O)CCC(=O)OCc1ccc(cc1)[C@@H](CN)C(=O)Nc1ccc2cnccc2c1 |r,c:14,t:10|

BDBM511485

C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COC(=O)C1CC1C(=O)OCc1ccc(cc1)[C@@H](CN)C(=O)Nc1ccc2cnccc2c1 |r,c:11,t:7|

BDBM511486

C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1CC[C@]2(O)C(=O)COC(=O)C1CC1C(=O)OCc1ccc(cc1)[C@@H](CN)C(=O)Nc1ccc2cnccc2c1 |r,c:13,t:9|

BDBM50434787

C[C@H](c1nc2cnc3c(c2n1C4CCC(CC4)CC#N)cc[nH]3)O

BDBM513960

N#CC[C@H]1CC[C@@H](CC1)n1c(nc2cnc3[nH]ccc3c12)-c1c[nH]cn1 |r,wU:3.2,wD:6.9,(5.82,3.67,;4.34,4.07,;2.85,4.47,;1.76,3.38,;2.16,1.89,;1.07,.81,;-.42,1.2,;-.82,2.69,;.27,3.78,;-1.51,.12,;-3.04,.28,;-3.66,-1.13,;-2.52,-2.16,;-2.52,-3.7,;-1.19,-4.47,;.15,-3.7,;1.61,-4.18,;2.52,-2.93,;1.61,-1.69,;.15,-2.16,;-1.19,-1.39,;-3.81,1.61,;-5.35,1.61,;-5.82,3.07,;-4.58,3.98,;-3.33,3.07,)|

BDBM515632

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCNC1=O

BDBM515633

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C)C1=O

BDBM515634

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCC1=O

BDBM515635

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCC2(CC2)C1=O

BDBM515636

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C2CC2)C1=O

BDBM515637

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C(C)C)C1=O

BDBM515638

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCC(C)(C)C1=O

BDBM515639

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(CC(F)F)C1=O

BDBM515640

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(CCOC)C1=O

BDBM515641

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C2CC(F)(F)C2)C1=O

BDBM515642

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C2CCC2)C1=O

BDBM515643

CCN1CCN(C1=O)c1cc(Nc2cccc(-c3ncn(C)n3)c2OC)c(nn1)C(=O)NC

BDBM515647

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C1=O)C1(C)COC1

BDBM515648

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(CC(C)C)C1=O

BDBM515649

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C2CCCC2)C1=O

BDBM515650

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C1=O)C12CC(C1)C2

BDBM515654

CNC(=O)c1c(F)nc(NC(=O)C2CC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM515655

COc1c(Nc2cc(NC(=O)C3CC3)nnc2C(C)=O)cccc1-c1ncn(C)n1

BDBM515656

CCC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM515657

COc1c(Nc2cc(NC(=O)C3CC3)nnc2C(=O)C2CC2)cccc1-c1ncn(C)n1

BDBM515658

COc1c(Nc2cc(NC(=O)C3CC3)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1

BDBM515659

CNC(=O)c1nnc(NC(=O)N2CCC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM515660

CNC(=O)c1nnc(NC(=O)N2CCCC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM515662

CNC(=O)c1nnc(NC(=O)N2CC3(CCC3)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM515663

COc1c(Nc2cc(NC(=O)N3CCC3)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1

BDBM515665

COc1c(Nc2cc(ncc2C(=O)C2CC2)N2CCN(C(C)C)C2=O)cccc1-c1ncn(C)n1

BDBM515666

COc1c(Nc2cc(NC(=O)C(C)C)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1

BDBM515667

COc1c(Nc2cc(Nc3ccccn3)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1

BDBM515668

CNC(=O)c1nnc(NC(=O)N2CC(C)(C)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM515669

COc1c(Nc2cc(NC(=O)C3CC3)nc3ncn(C)c(=O)c23)cccc1-c1ncn(C)n1

BDBM515670

CNC(=O)c1nnc(N\C(=N\O)C2CC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM515671

COc1c(Nc2cc(NC(=O)C3CC3)nc3CN4CC(=O)N=C4c23)cccc1-c1ncn(C)n1 |c:22|

BDBM515672

CNC(=O)c1c(F)nc(NC(=O)C2CC2)cc1Nc1cccc(-c2nnn(C)n2)c1OC

BDBM515673

COc1c(Nc2cc(NC(=O)C3CC3)nc3CNC(=O)c23)cccc1-c1ncn(C)n1

BDBM515674

COc1c(Nc2cc(NC(=O)C3CC3)nnc2C(=O)C(F)F)cccc1-c1ncn(C)n1

BDBM515675

CNC(=O)c1nnc(\C=C\C2CC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM515676

COc1c(Nc2cc(Cl)nnc2C(=O)C(F)F)cccc1-c1ncn(C)n1

BDBM515677

CNC(=O)c1nnc(NC(=O)N2CC(F)(F)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM515678

CNC(=O)c1cnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C(C)C)C1=O

BDBM515679

CNC(=O)c1nnc(NC(=O)N2CC(C)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM515681

COc1c(Nc2cc(NC(=O)C3CC3)ncc2C(=O)C2CC2)cccc1-c1nnn(C)n1

BDBM515682

COc1c(Nc2cc(Nc3ccncn3)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1

BDBM515683

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CC2(COC2)C1

BDBM515685

COc1c(Nc2cc(NC(=O)C3CC3)nc3cn(C)nc23)cccc1-c1ncn(C)n1

BDBM515686

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCCC1=O

BDBM515687

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CC(F)(F)C1=O

BDBM515688

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CC(F)(F)C1

BDBM515690

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCOC1=O

BDBM515691

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCC(C#N)(C2CC2)C1=O

BDBM515692

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CC(C)(C)C1

BDBM515693

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)-n1ccn(C)c1=O

BDBM515694

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCC(C)C1=O

BDBM515695

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)-n1cccn1

BDBM515696

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)-n1ccc(C)n1

BDBM515697

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(CC(F)(F)F)C1=O

BDBM515698

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(CC2CC2)C1=O

BDBM515699

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(CC#N)C1=O

BDBM515700

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCCC1

BDBM515701

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(CC2CCOC2)C1=O

BDBM515702

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(CC2(C)COC2)C1=O

BDBM515703

[#6]-[#7]-[#6](=O)-c1nnc(\[#6]=[#6](\[#6])-[#6])cc1-[#7]-c1cccc(-c2ncn(-[#6])n2)c1-[#8]-[#6]

BDBM515704

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(CC2CCCO2)C1=O

BDBM515705

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCC2(CCNCC2)C1=O

BDBM515706

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1C[C@H](O)CC1=O |r|

BDBM515707

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C1=O)c1ccccc1

BDBM515708

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C2C[C@@H]2F)C1=O |r|

BDBM515709

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C2COC2)C1=O

BDBM515710

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C2CCOC2)C1=O

BDBM515711

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C2CCC2O)C1=O

BDBM515712

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C(C)C2CC2)C1=O

BDBM515713

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C(C)C(F)(F)F)C1=O

BDBM515714

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C(C)C#C)C1=O

BDBM515715

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C(C)CO)C1=O

BDBM515716

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C2CCOCC2)C1=O

BDBM515717

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C(C2CC2)C(F)(F)F)C1=O

BDBM515718

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C1=O)C1(C)CC1

BDBM515719

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C1=O)C(C)(C)C

BDBM515720

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(CC(C)(C)O)C1=O

BDBM515721

CCCCN1CCN(C1=O)c1cc(Nc2cccc(-c3ncn(C)n3)c2OC)c(nn1)C(=O)NC

BDBM515722

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C(CO)C(C)C)C1=O

BDBM515723

CCN(CC)CCN1CCN(C1=O)c1cc(Nc2cccc(-c3ncn(C)n3)c2OC)c(nn1)C(=O)NC

BDBM515724

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C2CCC(F)(F)CC2)C1=O

BDBM515725

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C1=O)C1(CC1)C#N

BDBM515726

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(CC2CCC2)C1=O

BDBM515727

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C(C)COC)C1=O

BDBM515728

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C2CCCOC2)C1=O

BDBM515729

CCCN1CCN(C1=O)c1cc(Nc2cccc(-c3ncn(C)n3)c2OC)c(nn1)C(=O)NC

BDBM515730

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C2CC(C)C2)C1=O |(-7.83,-2.42,;-6.49,-3.19,;-5.16,-2.42,;-5.16,-.88,;-3.83,-3.19,;-3.83,-4.73,;-2.49,-5.5,;-1.16,-4.73,;-1.16,-3.19,;-2.49,-2.42,;-2.49,-.88,;-1.16,-.11,;.17,-.88,;1.51,-.11,;1.51,1.43,;.17,2.2,;.17,3.74,;-1.07,4.64,;-.6,6.11,;.94,6.11,;1.85,7.35,;1.42,4.64,;-1.16,1.43,;-2.49,2.2,;-2.49,3.74,;.17,-5.5,;.34,-7.03,;1.84,-7.35,;2.61,-6.02,;4.14,-5.86,;5.37,-6.79,;6.3,-5.57,;7.83,-5.37,;5.08,-4.64,;1.58,-4.88,;1.9,-3.37,)|

BDBM515731

CNC(=O)c1nnc(cc1Nc1cccc(-c2ncn(C)n2)c1OC)N1CCN(C2CC(C)(C)C2)C1=O

BDBM515732

CCC(CC)N1CCN(C1=O)c1cc(Nc2cccc(-c3ncn(C)n3)c2OC)c(nn1)C(=O)NC

BDBM515734

Cn1cnc(n1)-c1cccc2Nc3ccnnc3OCCOCCOc12

BDBM515735

CCC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM515736

COc1c(Nc2cc(Nc3cc(F)ccn3)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1

BDBM515737

COc1c(Nc2cc(N[S@](=O)C(C)(C)C)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1 |r|

BDBM515738

COc1c(Nc2cc(N[S@@](=O)C(C)(C)C)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1 |r|

BDBM515739

Cc1cccnc1Nc1cc(Nc2ccc(cn2)C(C)(C)O)ncc1C(=O)C1CC1

BDBM515741

COc1c(Nc2cc(Nc3cc(C)c(F)cn3)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1

BDBM515742

CNC(=O)c1nnc(cc1Nc1nccc(-c2ncn(C)n2)c1OC)N1CCN(C(C)C)C1=O

BDBM515743

Cc1cccnc1Nc1cc(Nc2ccc(c(F)n2)C(C)(C)O)ncc1C(=O)C1CC1

BDBM515744

CCC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM515745

COc1c(Nc2cc(NC(=O)C3CC3)ncc2C(=O)C2CC2)nccc1-c1ncn(C)n1

BDBM515748

CCC(=O)c1cnc(Nc2cccc(n2)C#N)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM515749

CCC(=O)c1cnc(Nc2cccc(n2)C#N)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM515750

CCC(=O)c1cnc(Nc2ccc(c(F)n2)C(C)(C)O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM515751

CCC(=O)c1cnc(Nc2ccc(c(F)n2)C(C)(C)O)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM515898

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccccc1

BDBM516024

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(c1)-c1ncn(C)n1

BDBM516278

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccccc1N1CCCS1(=O)=O

BDBM516279

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccccc1C1(CC1)S(C)(=O)=O

BDBM516281

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(c1)-n1ccc(C)n1

BDBM516282

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(c1)-n1nccn1

BDBM516283

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(cc1OC)C1=NC(C)(C)CO1 |t:31|

BDBM516284

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cc(ccn1)-c1csc(C)n1

BDBM516285

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(c1)C1=NC(C)(C)CS1 |t:29|

BDBM516286

Cn1cnc(n1)-c1cccc(c1)-c1cc2c(cnc(NC(=O)C3CC3)c2[nH]1)C(N)=O

BDBM516287

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cc(ccn1)-c1ncn(C)n1

BDBM516288

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cc(ccn1)-c1nccs1

BDBM516289

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cc(ccn1)-c1ncco1

BDBM516291

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cc(ccn1)-n1ccc(C)n1

BDBM516292

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(c1)-n1cnnc1

BDBM516293

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(-c2cnn(C)c2)c1F

BDBM516294

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc2cn(nc2c1)C1CC1

BDBM516295

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc2ccn(C)c2c1F

BDBM516296

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(N2CCOCC2)c1F

BDBM516297

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(-c2ncco2)c1F

BDBM516298

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(cc1OC)C(=O)N1CCC1

BDBM516299

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(cc1OC)C(=O)N1CCCC1

BDBM516300

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(cc1OC)N1CCCC1=O

BDBM516301

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(c1)-c1cnc(C)cn1

BDBM516302

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(c1)-c1nc(C)n(C)n1

BDBM516303

CNC(=O)c1ccc(-c2cc3c(cnc(NC(=O)C4CC4)c3[nH]2)C(=O)NC)c(OC)c1

BDBM516304

CNC(=O)CCCNc1ccc(-c2cc3c(cnc(NC(=O)C4CC4)c3[nH]2)C(=O)NC)c(OC)c1

BDBM516305

CCn1cc(ccc1=O)-c1cc2c(cnc(NC(=O)C3CC3)c2[nH]1)C(=O)NC

BDBM516306

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(n1)-c1ncn(C)n1

BDBM516307

CCOc1ncccc1-c1cc2c(cnc(NC(=O)C3CC3)c2[nH]1)C(=O)NC

BDBM516308

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccnc1OC1CC1

BDBM516310

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(-c2ncn(C)n2)c1F

BDBM516311

CCOc1ncc(cc1-c1cc2c(cnc(NC(=O)C3CC3)c2[nH]1)C(=O)NC)-c1ccn(C)n1

BDBM516312

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cc(cnc1OC1CC1)-c1ccn(C)n1

BDBM516313

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cc(cnc1OC1CC1)-c1nccs1

BDBM516314

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(=O)n(c1)C1CC1

BDBM516315

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(N2CCC2)c1C#N

BDBM516316

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(cc1F)C(=O)N1CCC1

BDBM516317

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccn(C2CCCOC2)c1=O |w:23.26|

BDBM516318

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cnccc1OC1CC1

BDBM516319

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(-c2cnn(C)c2)c1C#N

BDBM516320

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccccc1N1CCC(O)CC1

BDBM516321

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(c1F)-n1cnc(C)n1

BDBM516322

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(-c2cn(C)cn2)c1F

BDBM516323

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(n1)-c1nc(C)cn1C

BDBM516324

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(c1)-c1nnn(C)n1

BDBM516325

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ncc(cc1F)C(=O)N(C)C

BDBM516326

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(-c2nnn(C)n2)c1F

BDBM516327

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(cn1)C(=O)N1CC(F)(F)C1

BDBM516328

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccn(-c2ncc(C)s2)c1=O

BDBM516329

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccn([C@@H]2CCCOC2)c1=O |r|

BDBM516330

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccn([C@H]2CCCOC2)c1=O |r|

BDBM516331

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(cc1OC1CC1)-c1nccn1C

BDBM516332

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(cc1F)-c1nccn1C

BDBM516333

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(-c2nnn(C)n2)c1OC

BDBM516334

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(cc1OC)-c1nccs1

BDBM516335

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(cc1OC)C1COCCO1

BDBM516336

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(cc1F)-c1nncn1C

BDBM516337

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(c1F)-n1nccn1

BDBM516338

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(cc1OC)-c1cn(C)nn1

BDBM516339

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(cc1F)-n1ncnc1C

BDBM516340

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(cc1F)-c1cnccn1

BDBM516341

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(-c2cn(C)c(C)n2)c1F

BDBM516342

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(cc1F)-c1ncc(C)n1C

BDBM516343

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(-c2cn3CCCc3n2)c1F

BDBM516344

CCc1csc(n1)-c1cc2c(cnc(NC(=O)C3CC3)c2[nH]1)C(=O)NC

BDBM516345

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(OC)cc1[C@H]1COCCO1 |r|

BDBM516346

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(OC)cc1[C@@H]1COCCO1 |r|

BDBM516347

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(-c2nc(C)n(C)n2)c1F

BDBM516348

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(cc1F)-c1nc(C)c(C)n1C

BDBM516349

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(cc1F)-c1ncc2CCCCn12

BDBM516350

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(-c2cn3CCCOc3n2)c1F

BDBM516351

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1c(F)cc(cc1F)-c1nccn1C

BDBM516352

CCOc1cc(cc(F)c1-c1cc2c(cnc(NC(=O)C3CC3)c2[nH]1)C(=O)NC)-c1nccn1C

BDBM516353

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(-c2cn3CCOCc3n2)c1F

BDBM516354

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccn(n1)-c1cnn(C)c1

BDBM516355

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(-c2cnc(C)o2)c1F

BDBM516356

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1c(F)cc(cc1OC1CC1)-n1nccn1

BDBM516357

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1c(F)cc(cc1N1CCC(F)(F)C1)-c1nccn1C

BDBM516358

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(-c2cn3CCOC(C)(C)c3n2)c1F

BDBM516359

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(OC2CCOCC2)c1F

BDBM516360

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1c(F)cc(cc1N1CCOCC1)-c1nccn1C

BDBM516361

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(C2=NC(C)(C)CO2)c1F |t:27|

BDBM516362

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(OC[C@@H]2CCCO2)cc1F |r|

BDBM516364

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1c(F)cc(cc1N1CC[C@H](C1)OC)-c1nccn1C |r|

BDBM516365

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc([C@@H]2C[C@@H](C2)OC)c1F |r,wU:24.26,26.31,(-5.09,-5.64,;-5.09,-4.1,;-3.76,-3.33,;-2.42,-4.1,;-3.76,-1.79,;-5.09,-1.02,;-5.09,.52,;-3.76,1.29,;-3.76,2.83,;-5.09,3.6,;-5.09,5.14,;-6.42,2.83,;-7.96,2.83,;-7.19,1.5,;-2.42,.52,;-.96,1,;-.05,-.25,;-.96,-1.49,;-2.42,-1.02,;1.49,-.25,;2.26,-1.58,;3.8,-1.58,;4.57,-.25,;3.8,1.09,;4.57,2.42,;6.05,2.82,;5.65,4.3,;4.17,3.91,;6.42,5.64,;7.96,5.64,;2.26,1.09,;1.49,2.42,)|

BDBM516366

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc2nc(C)n(C)c2c1F

BDBM516367

CNC(=O)c1cnc(Nc2ccn(C)n2)c2[nH]c(cc12)-c1ccccc1

BDBM516368

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc([C@H]2C[C@@H](C2)OC)c1F |r,wU:24.26,wD:26.31,(-5.09,-5.64,;-5.09,-4.1,;-3.76,-3.33,;-2.42,-4.1,;-3.76,-1.79,;-5.09,-1.02,;-5.09,.52,;-3.76,1.29,;-3.76,2.83,;-5.09,3.6,;-5.09,5.14,;-6.42,2.83,;-7.96,2.83,;-7.19,1.5,;-2.42,.52,;-.96,1,;-.05,-.25,;-.96,-1.49,;-2.42,-1.02,;1.49,-.25,;2.26,-1.58,;3.8,-1.58,;4.57,-.25,;3.8,1.09,;4.57,2.42,;4.17,3.91,;5.65,4.3,;6.05,2.82,;6.42,5.64,;7.96,5.64,;2.26,1.09,;1.49,2.42,)|

BDBM516369

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1cccc(C2CCCO2)c1F

BDBM516370

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)N1CCCCC1

BDBM516371

CNC(=O)c1cnc(Nc2ccn(C)n2)c2[nH]c(cc12)-c1cccc(-c2cnn(C)c2)c1F

BDBM516372

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(cc1F)C(=O)N1CC(F)(F)C1

BDBM516373

CNC(=O)c1cnc(Nc2ccn(C)n2)c2[nH]c(cc12)-c1cccc(-c2cnc(C)o2)c1F

BDBM516374

CNC(=O)c1cnc(Nc2ccn(C)n2)c2[nH]c(cc12)-c1cccc(-c2cn3CCOCc3n2)c1F

BDBM516375

CNC(=O)c1cnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(cc1F)-c1ccn(C)n1

BDBM523906

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC(CC)CC)c3n2)cn1

BDBM523907

CCC(CC)Cn1ccc2cnc(Nc3cnn(CC(O)=O)c3)nc12

BDBM523908

CCOC(=O)Cn1cc(Nc2ncc3ccn(Cc4ccsc4)c3n2)cn1

BDBM523909

OC(=O)Cn1cc(Nc2ncc3ccn(Cc4ccsc4)c3n2)cn1

BDBM523911

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC4CCCCC4)c3n2)cn1

BDBM523913

OC(=O)Cn1cc(Nc2ncc3ccn(CC4CCCCC4)c3n2)cn1

BDBM523914

CCOC(=O)CCn1cc(Nc2ncc3ccn(Cc4ccsc4)c3n2)cn1

BDBM523917

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC4CCCC4)c3n2)cn1

BDBM523918

CCOC(=O)Cn1cc(Nc2ncc3ccn(CCC4CCCCC4)c3n2)cn1

BDBM523919

OC(=O)CCn1cc(Nc2ncc3ccn(Cc4ccsc4)c3n2)cn1

BDBM523920

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC(C)(C)C)c3n2)cn1

BDBM523921

CCOC(=O)Cn1cc(Nc2ncc3ccn(CCC(C)C)c3n2)cn1

BDBM523922

[#6]-[#6]-[#8]-[#6](=O)-[#6]-n1cc(-[#7]-c2ncc3ccn(-[#6]\[#6]=[#6](/[#6])-[#6])c3n2)cn1

BDBM523923

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC#CC)c3n2)cn1

BDBM523924

CCOC(=O)Cn1cc(Nc2ncc3ccn(CCC#N)c3n2)cn1

BDBM523925

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC4CC4)c3n2)cn1

BDBM523926

CCOC(=O)c1ccc(Nc2ncc3ccn(CC(CC)CC)c3n2)cc1

BDBM523927

CCOC(=O)C(C)(C)n1cc(Nc2ncc3ccn(CC(CC)CC)c3n2)cn1

BDBM523928

CCOC(=O)C(C)n1cc(Nc2ncc3ccn(CC(CC)CC)c3n2)cn1

BDBM523930

CCC(Cn1ccc2cnc(Nc3cnn(CC(O)=O)c3)nc12)C(C)C

BDBM523931

CCOC(=O)CCn1cc(Nc2ncc3ccn(CC(CC)C(C)C)c3n2)cn1

BDBM523932

CCC(Cn1ccc2cnc(Nc3cnn(CCC(O)=O)c3)nc12)C(C)C

BDBM523935

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC45CC6CC(CC(C6)C4)C5)c3n2)cn1 |TLB:25:24:27:21.20.19,25:20:27:24.26.23,THB:26:24:21:27.18.19,26:18:21:24.25.23|

BDBM523936

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC4CCCCC4(F)F)c3n2)cn1

BDBM523937

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC4CCCC(F)(F)C4)c3n2)cn1

BDBM523938

OC(=O)Cn1cc(Nc2ncc3ccn(CC4CCCCC4(F)F)c3n2)cn1

BDBM523939

OC(=O)Cn1cc(Nc2ncc3ccn(CC4CCCC(F)(F)C4)c3n2)cn1

BDBM523940

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC4CCC(F)(F)CC4)c3n2)cn1

BDBM523941

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC4CC5CCC4C5)c3n2)cn1

BDBM523943

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC4(C)CCCC4)c3n2)cn1

BDBM523946

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC4CCCCC4C)c3n2)cn1

BDBM523947

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC4CCCCCC4)c3n2)cn1

BDBM523948

CCOC(=O)Cn1ccc(Nc2ncc3ccn(CC(CC)CC)c3n2)n1

BDBM523949

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC4CCCC(C)C4)c3n2)cn1

BDBM523951

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC4CCC(C)CC4)c3n2)cn1 |(8.31,4.13,;6.78,4.34,;5.84,3.12,;4.31,3.33,;3.73,4.76,;3.37,2.12,;1.83,2.28,;.8,1.13,;-.6,1.76,;-1.94,.99,;-3.27,1.76,;-3.27,3.3,;-4.6,4.07,;-5.94,3.3,;-7.4,3.78,;-8.31,2.53,;-7.4,1.28,;-7.88,-.18,;-6.85,-1.33,;-7.32,-2.79,;-6.29,-3.93,;-4.79,-3.61,;-3.76,-4.76,;-4.31,-2.15,;-5.34,-1.01,;-5.94,1.76,;-4.6,.99,;-.44,3.29,;1.06,3.61,)|

BDBM523952

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC4(C)CCCCC4)c3n2)cn1

BDBM523955

CCOC(=O)Cn1cc(Nc2ncc3ccn(C[C@@H]4C[C@@H]5C[C@@H]5C4)c3n2)cn1 |r|

BDBM523957

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC(CC)C(C)C)c3n2)cn1

BDBM523958

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC(C(C)C)C(C)C)c3n2)cn1

BDBM523959

CCOC(=O)Cn1cc(Nc2ncc3ccn(C[C@H]4CC[C@H](O)CC4)c3n2)cn1 |r,wU:18.17,wD:21.21,(11.11,2.89,;9.58,3.1,;8.63,1.89,;7.11,2.1,;6.53,3.52,;6.16,.88,;4.63,1.04,;3.6,-.1,;2.2,.52,;.86,-.25,;-.47,.52,;-.47,2.06,;-1.81,2.83,;-3.14,2.06,;-4.6,2.54,;-5.51,1.29,;-4.6,.05,;-5.08,-1.42,;-6.59,-1.74,;-7.06,-3.2,;-8.57,-3.52,;-9.6,-2.38,;-11.11,-2.7,;-9.12,-.91,;-7.62,-.59,;-3.14,.52,;-1.81,-.25,;2.36,2.05,;3.86,2.37,)|

BDBM523960

CCOC(=O)Cn1cc(Nc2ncc3ccn(C[C@@H]4CC[C@H](O)CC4)c3n2)cn1 |r,wD:18.17,21.21,(11.11,2.89,;9.58,3.1,;8.63,1.89,;7.11,2.1,;6.53,3.52,;6.16,.88,;4.63,1.04,;3.6,-.1,;2.2,.52,;.86,-.25,;-.47,.52,;-.47,2.06,;-1.81,2.83,;-3.14,2.06,;-4.6,2.54,;-5.51,1.29,;-4.6,.05,;-5.08,-1.42,;-6.59,-1.74,;-7.06,-3.2,;-8.57,-3.52,;-9.6,-2.38,;-11.11,-2.7,;-9.12,-.91,;-7.62,-.59,;-3.14,.52,;-1.81,-.25,;2.36,2.05,;3.86,2.37,)|

BDBM523961

CCOC(=O)Cn1cc(Nc2ncc3ccn(Cc4csc(C)n4)c3n2)cn1

BDBM523967

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC(CC)CO)c3n2)cn1

BDBM523968

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC(CC)CC#N)c3n2)cn1

BDBM523969

CC[C@H](Cn1ccc2cnc(Nc3cnn(c3)C3CCOC3=O)nc12)C(C)C |r|

BDBM523970

CC[C@H](Cn1ccc2cnc(Nc3cnn(c3)[C@@H]3CCOC3=O)nc12)C(C)C |r|

BDBM523971

CC[C@H](Cn1ccc2cnc(Nc3cnn(c3)[C@H]3CCOC3=O)nc12)C(C)C |r|

BDBM523972

CCC(Cn1ccc2cnc(Nc3cnn(CC(=O)OC(C)C)c3)nc12)C(C)C

BDBM523973

CCCCOC(=O)Cn1cc(Nc2ncc3ccn(CC(CC)C(C)C)c3n2)cn1

BDBM523974

CCC(Cn1ccc2cnc(Nc3cnn(CC(=O)OCCO)c3)nc12)C(C)C

BDBM523975

CCOCCOC(=O)Cn1cc(Nc2ncc3ccn(CC(CC)C(C)C)c3n2)cn1

BDBM523976

CC(C)C(Cn1ccc2cnc(Nc3cnn(CC(O)=O)c3)nc12)C(C)C

BDBM523977

CC(C)C(Cn1ccc2cnc(Nc3cnn(CC(=O)OCCO)c3)nc12)C(C)C

BDBM523978

CCC(CC)Cn1ccc2cnc(Nc3cnn(CC(=O)OCCC#N)c3)nc12

BDBM523980

CCC(CC)Cn1ccc2cnc(Nc3cnn(CC(=O)OCCO)c3)nc12

BDBM523981

CCC(CC)Cn1ccc2cnc(Nc3cnn(CC(=O)OC4CC(C4)C#N)c3)nc12 |(-10.97,-2.78,;-9.46,-2.46,;-8.43,-3.6,;-8.9,-5.07,;-10.41,-5.39,;-6.92,-3.28,;-6.45,-1.82,;-7.35,-.57,;-6.45,.67,;-4.98,.2,;-3.65,.97,;-2.31,.2,;-2.31,-1.34,;-.98,-2.11,;.35,-1.34,;.51,.19,;2.02,.51,;2.79,-.82,;4.32,-.98,;5.27,.23,;4.69,1.66,;6.79,.02,;7.74,1.24,;9.27,1.43,;9.09,2.97,;7.55,2.76,;10.03,4.19,;10.98,5.41,;1.76,-1.97,;-3.65,-2.11,;-4.98,-1.34,)|

BDBM523983

CCC(Cn1ccc2cnc(Nc3cnn(CC(=O)OCCC#N)c3)nc12)C(C)C

BDBM523984

CCC(CC)Cn1ccc2cnc(Nc3cnn(CC(=O)OC(C)C)c3)nc12

BDBM523985

CC(C)OC(=O)Cn1cc(Nc2ncc3ccn(CC(C(C)C)C(C)C)c3n2)cn1

BDBM523987

CC(C)OC(=O)Cn1cc(Nc2ncc3ccn(C[C@@H](CCN(C)C)C(C)C)c3n2)cn1 |r|

BDBM523988

CC(C)OC(=O)Cn1cc(Nc2ncc3ccn(C[C@@H](CCO)C(C)C)c3n2)cn1 |r|

BDBM523989

CC(C)OC(=O)Cn1cc(Nc2ncc3ccn(C[C@@H](CCCl)C(C)C)c3n2)cn1 |r|

BDBM523990

CC(C)OC(=O)Cn1cc(Nc2ncc3ccn(C[C@@H](CCF)C(C)C)c3n2)cn1 |r|

BDBM523991

CCC[C@H](Cn1ccc2cnc(Nc3cnn(CC(=O)OC(C)C)c3)nc12)C(C)C |r|

BDBM523992

CCC(Cn1ccc2cnc(Nc3cnn(CC(=O)OC(C)C)c3)nc12)CC(F)(F)F

BDBM523993

CC(C)OC(=O)Cn1cc(Nc2ncc3ccn(C[C@@H](CC=C)C(C)C)c3n2)cn1 |r|

BDBM523994

CCC(CC)Cn1ccc2cnc(Nc3cnn(CC(=O)OCCN(C)C)c3)nc12

BDBM523995

CC[C@H](Cn1ccc2cnc(Nc3cnn(CC(O)=O)c3)nc12)C(C)C |r|

BDBM523996

CCC(Cn1ccc2cnc(Nc3cnn(CC(=O)O[C@@H](C)CO)c3)nc12)C(C)C |r|

BDBM523997

CCC(Cn1ccc2cnc(Nc3cnn(CC(=O)O[C@H](C)CO)c3)nc12)C(C)C |r|

BDBM523998

CCC(C)OC(=O)Cn1cc(Nc2ncc3ccn(CC(CC)C(C)C)c3n2)cn1

BDBM523999

CCC(Cn1ccc2cnc(Nc3cnn(CC(=O)OCC(C)C)c3)nc12)C(C)C

BDBM524000

CCC(Cn1ccc2cnc(Nc3cnn(CC(=O)OC(C)C(C)O)c3)nc12)C(C)C

BDBM524002

CCC(Cn1ccc2cnc(Nc3cnn(CC(=O)OC[C@@H](C)O)c3)nc12)C(C)C |r|

BDBM524003

CCC(Cn1ccc2cnc(Nc3cnn(CC(=O)OCC(O)CO)c3)nc12)C(C)C

BDBM524005

CCC(Cn1ccc2cnc(Nc3cnn(CC(=O)OC[C@H](C)O)c3)nc12)C(C)C |r|

BDBM524006

CCC(CC)Cn1ccc2cnc(Nc3cnn(CC(=O)OC(C)C(C)O)c3)nc12

BDBM524007

CC[C@@H](Cn1ccc2cnc(Nc3cnn(c3)C(C)C(O)=O)nc12)C(C)C |r|

BDBM524008

CC[C@H](Cn1ccc2cnc(Nc3cnn(CCC(O)=O)c3)nc12)C(C)C |r|

BDBM524009

CC(C(O)=O)n1cc(Nc2ncc3ccn(C[C@H]4CC[C@H](O)CC4)c3n2)cn1 |r,wU:17.16,wD:20.20,(8.48,2.46,;7.57,1.22,;8.17,-.19,;9.7,-.38,;7.25,-1.42,;6.04,1.39,;5.01,.24,;3.6,.87,;2.27,.1,;.93,.87,;.93,2.41,;-.4,3.18,;-1.73,2.41,;-3.2,2.88,;-4.1,1.64,;-3.2,.39,;-3.68,-1.07,;-5.18,-1.39,;-5.66,-2.86,;-7.16,-3.18,;-8.19,-2.03,;-9.7,-2.35,;-7.72,-.57,;-6.21,-.25,;-1.73,.87,;-.4,.1,;3.76,2.4,;5.27,2.72,)|

BDBM524010

O[C@H]1CC[C@H](Cn2ccc3cnc(Nc4cnn(CCC(O)=O)c4)nc23)CC1 |r,wU:1.0,wD:4.4,(-10.32,-2.53,;-8.81,-2.21,;-8.33,-.74,;-6.83,-.42,;-5.8,-1.57,;-4.29,-1.25,;-3.81,.22,;-4.72,1.46,;-3.81,2.71,;-2.35,2.23,;-1.02,3,;.32,2.23,;.32,.69,;1.65,-.08,;2.99,.69,;3.15,2.22,;4.65,2.54,;5.42,1.21,;6.95,1.05,;7.87,2.29,;9.4,2.11,;10.32,3.35,;10.01,.7,;4.39,.07,;-1.02,-.08,;-2.35,.69,;-6.27,-3.03,;-7.78,-3.35,)|

BDBM524011

CCOC(=O)C(C)n1cc(Nc2ncc3ccn(C[C@@H](CC)C(C)C)c3n2)cn1 |r|

BDBM524012

CCOC(=O)CCn1cc(Nc2ncc3ccn(C[C@@H](CC)C(C)C)c3n2)cn1 |r|

BDBM524013

CCOC(=O)C(C)n1cc(Nc2ncc3ccn(C[C@H]4CC[C@H](O)CC4)c3n2)cn1 |r,wU:19.18,wD:22.22,(11.08,3.01,;9.55,3.18,;8.63,1.94,;7.1,2.11,;6.49,3.53,;6.19,.88,;6.81,-.53,;4.66,1.04,;3.63,-.11,;2.22,.52,;.89,-.25,;-.45,.52,;-.45,2.06,;-1.78,2.83,;-3.11,2.06,;-4.58,2.53,;-5.48,1.29,;-4.58,.04,;-5.05,-1.42,;-6.56,-1.74,;-7.04,-3.21,;-8.54,-3.53,;-9.57,-2.38,;-11.08,-2.7,;-9.1,-.92,;-7.59,-.6,;-3.11,.52,;-1.78,-.25,;2.38,2.05,;3.89,2.37,)|

BDBM524014

CCOC(=O)CCn1cc(Nc2ncc3ccn(C[C@H]4CC[C@H](O)CC4)c3n2)cn1 |r,wU:19.18,wD:22.22,(11.56,3.87,;10.6,2.66,;9.07,2.83,;8.16,1.6,;8.77,.18,;6.63,1.77,;5.71,.53,;4.18,.69,;3.15,-.45,;1.74,.17,;.41,-.6,;-.92,.17,;-.92,1.71,;-2.26,2.48,;-3.59,1.71,;-5.05,2.19,;-5.96,.94,;-5.05,-.3,;-5.53,-1.77,;-7.04,-2.09,;-7.51,-3.55,;-9.02,-3.87,;-10.05,-2.73,;-11.56,-3.05,;-9.57,-1.26,;-8.07,-.94,;-3.59,.17,;-2.26,-.6,;1.91,1.71,;3.41,2.03,)|

BDBM524015

CC(C)OC(=O)Cn1cc(Nc2ncc3ccn(C[C@H]4CC[C@H](O)CC4)c3n2)cn1 |r,wU:19.18,wD:22.22,(11.08,2.47,;9.55,2.65,;8.94,4.06,;8.63,1.41,;7.1,1.58,;6.49,2.99,;6.19,.34,;4.66,.5,;3.63,-.64,;2.22,-.01,;.89,-.78,;-.45,-.01,;-.45,1.53,;-1.78,2.3,;-3.11,1.53,;-4.58,2,;-5.48,.76,;-4.58,-.49,;-5.05,-1.95,;-6.56,-2.27,;-7.04,-3.74,;-8.54,-4.06,;-9.57,-2.91,;-11.08,-3.23,;-9.1,-1.45,;-7.59,-1.13,;-3.11,-.01,;-1.78,-.78,;2.38,1.52,;3.89,1.84,)|

BDBM524016

CCOC(=O)Cn1cc(Nc2ncc3ccn(C[C@H]4CC[C@@H](CC4)NC)c3n2)cn1 |r,wU:21.24,wD:18.17,(11.62,3.01,;10.09,3.18,;9.17,1.94,;7.64,2.11,;7.03,3.53,;6.73,.88,;5.19,1.04,;4.16,-.11,;2.76,.52,;1.42,-.25,;.09,.52,;.09,2.06,;-1.24,2.83,;-2.58,2.06,;-4.04,2.53,;-4.95,1.29,;-4.04,.04,;-4.52,-1.42,;-6.02,-1.74,;-7.05,-.6,;-8.56,-.92,;-9.04,-2.38,;-8.01,-3.53,;-6.5,-3.21,;-10.54,-2.7,;-11.62,-1.61,;-2.58,.52,;-1.24,-.25,;2.92,2.05,;4.42,2.37,)|

BDBM524017

CCOC(=O)Cn1cc(Nc2ncc3ccn(C[C@H]4CC[C@@H](CC4)NC(=O)C=C)c3n2)cn1 |r,wU:18.17,wD:21.24,(12.31,4.22,;10.78,4.39,;9.86,3.15,;8.33,3.33,;7.72,4.74,;7.42,2.09,;5.89,2.25,;4.86,1.11,;3.45,1.73,;2.12,.96,;.78,1.73,;.78,3.27,;-.55,4.04,;-1.89,3.27,;-3.35,3.75,;-4.26,2.5,;-3.35,1.26,;-3.83,-.21,;-5.33,-.53,;-5.81,-1.99,;-7.31,-2.31,;-8.34,-1.17,;-7.87,.3,;-6.36,.62,;-9.85,-1.49,;-10.33,-2.95,;-9.3,-4.1,;-11.83,-3.27,;-12.31,-4.74,;-1.89,1.73,;-.55,.96,;3.61,3.26,;5.12,3.58,)|

BDBM524018

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC4CCS(=O)(=O)CC4)c3n2)cn1

BDBM524019

CCOC(=O)Cn1cc(Nc2ncc3ccn(CC4CCSCC4)c3n2)cn1

BDBM524020

CCOC(=O)Cn1cc(Nc2ncc3ccn(C[C@H]4CC[C@H](N)CC4)c3n2)cn1 |r,wU:21.21,wD:18.17,(11.08,3.01,;9.55,3.18,;8.63,1.94,;7.1,2.11,;6.49,3.53,;6.19,.88,;4.66,1.04,;3.63,-.11,;2.22,.52,;.89,-.25,;-.45,.52,;-.45,2.06,;-1.78,2.83,;-3.11,2.06,;-4.58,2.53,;-5.48,1.29,;-4.58,.04,;-5.05,-1.42,;-6.56,-1.74,;-7.59,-.6,;-9.1,-.92,;-9.57,-2.38,;-11.08,-2.7,;-8.54,-3.53,;-7.04,-3.21,;-3.11,.52,;-1.78,-.25,;2.38,2.05,;3.89,2.37,)|

BDBM524021

CCOC(=O)Cn1cc(Nc2ncc3ccn(C[C@H]4CC[C@H](CC4)OC)c3n2)cn1 |r,wU:18.17,21.24,(11.32,3.33,;9.79,3.5,;8.87,2.26,;7.34,2.43,;6.73,3.85,;6.43,1.2,;4.9,1.36,;3.87,.21,;2.46,.84,;1.12,.07,;-.21,.84,;-.21,2.38,;-1.54,3.15,;-2.88,2.38,;-4.34,2.86,;-5.25,1.61,;-4.34,.36,;-4.82,-1.1,;-6.32,-1.42,;-6.8,-2.89,;-8.31,-3.21,;-9.34,-2.06,;-8.86,-.6,;-7.35,-.28,;-10.84,-2.38,;-11.32,-3.85,;-2.88,.84,;-1.54,.07,;2.62,2.37,;4.13,2.69,)|

BDBM524022

CCOC(=O)Cn1cc(Nc2ncc3ccn(C[C@H]4CC[C@@H](CC4)OC)c3n2)cn1 |r,wU:18.17,wD:21.24,(11.32,3.33,;9.79,3.5,;8.87,2.26,;7.34,2.43,;6.73,3.85,;6.43,1.2,;4.9,1.36,;3.87,.21,;2.46,.84,;1.12,.07,;-.21,.84,;-.21,2.38,;-1.54,3.15,;-2.88,2.38,;-4.34,2.86,;-5.25,1.61,;-4.34,.36,;-4.82,-1.1,;-6.32,-1.42,;-6.8,-2.89,;-8.31,-3.21,;-9.34,-2.06,;-8.86,-.6,;-7.35,-.28,;-10.84,-2.38,;-11.32,-3.85,;-2.88,.84,;-1.54,.07,;2.62,2.37,;4.13,2.69,)|

BDBM524023

CCOC(=O)Cn1cc(Nc2ncc3ccn(C[C@H]4CCC[C@H](C4)OC)c3n2)cn1 |r|

BDBM524024

CCOC(=O)Cn1cc(Nc2ncc3ccn(C[C@@H]4CCC[C@H](C4)OC)c3n2)cn1 |r|

BDBM524025

CC[C@@H](Cn1ccc2cnc(Nc3cnn(CC(=O)OC(C)C)c3)nc12)C(C)C |r|

BDBM524026

CCOC(=O)Cn1cc(Nc2ncc3ccn(C[C@H](CC)C(C)C)c3n2)cn1 |r|

BDBM524027

CC[C@H](Cn1ccc2cnc(Nc3cnn(CC(=O)OC(C)C)c3)nc12)C(C)C |r|

BDBM524028

CCOC(=O)Cn1cc(Nc2ncc3ccn(C[C@@H](CC)C(C)C)c3n2)cn1 |r|

BDBM524029

CC[C@H](Cn1ccc2cnc(Nc3cnn(c3)C(CCO)C(O)=O)nc12)C(C)C |r|

BDBM524030

CCC(Cn1ccc2cnc(Nc3cnn(c3)C(=O)OC(C)(C)C)nc12)C(C)C

BDBM524031

CC[C@H](Cn1ccc2cnc(Nc3cnn(CC(=O)O[C@H]4CCN(C)C4)c3)nc12)C(C)C |r|

BDBM524032

CC[C@H](Cn1ccc2cnc(Nc3cnn(CC(=O)O[C@@H]4CCN(C)C4)c3)nc12)C(C)C |r|

BDBM524033

CC[C@H](Cn1ccc2cnc(Nc3cnn(CC(=O)OC4COC4)c3)nc12)C(C)C |r|

BDBM524034

CC[C@H](Cn1ccc2cnc(Nc3cnn(CC(=O)OCC4COC4)c3)nc12)C(C)C |r|

BDBM524035

CCC(CC)Cn1ccc2cnc(Nc3cnn(c3)C3CCOC3=O)nc12

BDBM524036

CC[C@H](Cn1ccc2cnc(Nc3cnn(c3)[C@@H](CCO)C(O)=O)nc12)C(C)C |r|

BDBM524037

CC[C@H](Cn1ccc2cnc(Nc3cnn(c3)C3CC(C)(C)OC3=O)nc12)C(C)C |r|

BDBM524038

CCC(CC)Cn1ccc2cnc(Nc3cnn(CC(=O)OCC4OC(O)CC(O)C4O)c3)nc12

BDBM524039

CN1CC[C@H](C1)OC(=O)Cn1cc(Nc2ncc3ccn(C[C@H]4CC[C@H](O)CC4)c3n2)cn1 |r,wU:22.22,4.6,wD:25.26,(7.3,6.51,;7.3,4.97,;8.55,4.07,;8.07,2.6,;6.53,2.6,;6.06,4.07,;5.59,1.38,;4.07,1.58,;3.48,3.01,;3.13,.36,;1.59,.53,;.56,-.62,;-.84,.01,;-2.18,-.76,;-3.51,.01,;-3.51,1.55,;-4.84,2.32,;-6.18,1.55,;-7.64,2.02,;-8.55,.78,;-7.64,-.47,;-8.12,-1.93,;-7.09,-3.08,;-5.58,-2.76,;-4.55,-3.9,;-5.03,-5.37,;-4,-6.51,;-6.53,-5.69,;-7.56,-4.54,;-6.18,.01,;-4.84,-.76,;-.68,1.54,;.82,1.86,)|

BDBM524040

CC[C@H](Cn1ccc2cnc(Nc3cnn(c3)C(CC(C)(C)O)C(O)=O)nc12)C(C)C |r|

BDBM771878

O=C(Nc1nc2cccc(C3CCC4(CC3)CN(C(=O)C3CC3)C4)n2n1)C1CC1

BDBM771879

N#CC1CC1C(=O)N1CC2(CCC(c3cccc4nc(NC(=O)C5CC5)nn34)CC2)C1

BDBM50602438

FC1(CC1)C(=O)N1CC2(C1)CCC(CC2)c1cccc2nc(NC(=O)C3CC3)nn12

BDBM50602434

FC(F)(F)CC(=O)N1CC2(C1)CCC(CC2)c1cccc2nc(NC(=O)C3CC3)nn12

BDBM50602439

O=C(Nc1nc2cccc(C3CCC4(CN(C4)C(=O)C4(CC4)C#N)CC3)n2n1)C1CC1

BDBM50602436

FC1(F)C[C@@H]1C(=O)N1CC2(C1)CCC(CC2)c1cccc2nc(NC(=O)C3CC3)nn12 |r|

BDBM50602437

FC1(F)C[C@H]1C(=O)N1CC2(C1)CCC(CC2)c1cccc2nc(NC(=O)C3CC3)nn12 |r|

BDBM50602440

FC(F)CC(=O)N1CC2(C1)CCC(CC2)c1cccc2nc(NC(=O)C3CC3)nn12

BDBM772406

CC(C)(C#N)CC(=O)N1CC2(CCC(c3cccc4nc(NC(=O)C5CC5)nn34)CC2)C1

BDBM50602442

O=C(Nc1nc2cccc(C3CCC4(CN(CC#N)C4)CC3)n2n1)C1CC1

BDBM50602443

O=C(Nc1nc2cccc(C3CCC4(CN(CCC#N)C4)CC3)n2n1)C1CC1

BDBM772414

O=C(Nc1nc2cccc(C3CCC4CCN(C(=O)[C@@H]5CC5(F)F)CCC4C3)n2n1)C1CC1

BDBM772415

N#CCC(=O)N1CCC2CCC(c3cccc4nc(NC(=O)C5CC5)nn34)CC2CC1

BDBM772416

O=C(Nc1nc2cccc(C3CCC4CCN(C(=O)CC(F)(F)F)CCC4C3)n2n1)C1CC1

BDBM656603

FC1(CCC2(CN(C2)C(=O)CC#N)CC1)c1cccc2nc(NC(=O)C3CC3)nn12

BDBM656604

FC(F)(F)CC(=O)N1CC2(C1)CCC(F)(CC2)c1cccc2nc(NC(=O)C3CC3)nn12

BDBM656605

FC(F)CC(=O)N1CC2(C1)CCC(F)(CC2)c1cccc2nc(NC(=O)C3CC3)nn12

BDBM772420

O=C(Nc1nc2cccc(C3CCC4(CC3)CCN(C(=O)C3CC3(F)F)C4)n2n1)C1CC1

BDBM772421

O=C(Nc1nc2cccc(C3CCC4(CC3)CCN(C(=O)C3CC3(F)F)C4)n2n1)C1CC1

BDBM656608

O=C(CC#N)N1CC[C@@]2(C1)CCC(CC2)c1cccc2nc(NC(=O)C3CC3)nn12 |r,wD:8.8,(3.05,14.56,;3.68,13.16,;5.21,13,;6.11,14.24,;7.02,15.49,;2.77,11.91,;1.23,11.91,;.76,10.45,;2,9.54,;3.25,10.45,;3.34,8.77,;3.34,7.23,;2,6.46,;.67,7.23,;.67,8.77,;2,4.92,;3.34,4.15,;3.34,2.61,;2,1.84,;.67,2.61,;-.8,2.13,;-1.7,3.38,;-3.24,3.38,;-4.01,2.05,;-3.24,.71,;-5.55,2.05,;-6.89,2.82,;-6.89,1.28,;-.8,4.63,;.67,4.15,)|

BDBM50602432

FC(F)(F)CC(=O)N1CCC2(C1)CCC(CC2)c1cccc2nc(NC(=O)C3CC3)nn12

BDBM50602418

FC1(F)C[C@H]1C(=O)N1CCC2(CC[C@@H](C2)c2cccc3nc(NC(=O)C4CC4)nn23)CC1 |r|

BDBM50602419

FC1(F)C[C@H]1C(=O)N1CCC2(CC[C@H](C2)c2cccc3nc(NC(=O)C4CC4)nn23)CC1 |r|

BDBM50602420

FC1(F)C[C@H]1C(=O)N1CC2(C1)CC[C@@H](C2)c1cccc2nc(NC(=O)C3CC3)nn12 |r|

BDBM50602421

FC1(F)C[C@H]1C(=O)N1CC2(C1)CC[C@H](C2)c1cccc2nc(NC(=O)C3CC3)nn12 |r|

BDBM772428

O=C(Nc1nc2cccc(C3CCC4(CC3)CN(C(=O)[C@H]3CC3(F)F)C4)n2n1)[C@H]1CC1(F)F

BDBM656615

FC1(F)C[C@@H]1C(=O)Nc1nc2cccc(C3CCC4(CN(C4)C(=O)C4(F)CC4)CC3)n2n1 |r|

BDBM656616

FC1(F)C[C@@H]1C(=O)Nc1nc2cccc(C3CCC4(CN(C4)C(=O)CC#N)CC3)n2n1 |r|

BDBM656617

FC1(F)C[C@@H]1C(=O)Nc1nc2cccc(C3CCC4(CN(CC#N)C4)CC3)n2n1 |r|

BDBM772432

O=C(Nc1nc2cccc(C3CCC4(CC3)CN(C(=O)[C@H]3CC3(F)F)C4)n2n1)[C@@H]1CC1(F)F

BDBM656619

FC1(F)C[C@H]1C(=O)Nc1nc2cccc(C3CCC4(CN(C4)C(=O)C4(F)CC4)CC3)n2n1 |r|

BDBM772434

N#CCC(=O)N1CC2(CCC(c3cccc4nc(NC(=O)[C@@H]5CC5(F)F)nn34)CC2)C1

BDBM656621

FC1(F)C[C@H]1C(=O)Nc1nc2cccc(C3CCC4(CN(CC#N)C4)CC3)n2n1 |r|

BDBM772436

N#CCC(=O)N1CCC2CCC(c3c(F)ccc4nc(NC(=O)C5CC5)nn34)CC2CC1

BDBM538636

FC(F)(F)CN1CC(CC#N)(C1)n1cc(cn1)-c1nc(cc2ncccc12)-c1cn[nH]c1

BDBM538644

N#CCC1CC(CC#N)(C1)n1cc(cn1)-c1nc(cc2ncccc12)-c1cn[nH]c1

BDBM538659

N#CCC1CC(CC#N)(C1)n1cc(cn1)-c1nc(cc2ncccc12)-c1cn[nH]c1

BDBM538666

Cn1cc(cn1)-c1cc2ncccc2c(n1)-c1cnn(c1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538667

OCCn1cc(cn1)-c1cc2ncccc2c(n1)-c1cnn(c1)C1(CC#N)CC(C1)C#N |(-6.13,-1.87,;-4.6,-2.03,;-3.97,-3.44,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,)|

BDBM538669

COC1CC(CC#N)(C1)n1cc(cn1)-c1nc(cc2ncccc12)-c1cnn(CCO)c1

BDBM538670

COC1CC(CC#N)(C1)n1cc(cn1)-c1nc(cc2ncccc12)-c1cnn(CCO)c1

BDBM538671

FC(F)(F)CN1CC(CC#N)(C1)n1cc(cn1)-c1nc(cc2ncccc12)-c1cnn(c1)C1CCOCC1

BDBM538672

COC1CC(CC#N)(C1)n1cc(cn1)-c1nc(cc2ncccc12)-c1cc(CO)n[nH]1

BDBM538673

COC1CC(CC#N)(C1)n1cc(cn1)-c1nc(cc2ncccc12)-c1cc(CO)n[nH]1

BDBM538674

FC(F)(F)CN1CC(CC#N)(C1)n1ccc(n1)-c1nc(Cl)cc2ncccc12

BDBM538675

FC(F)(F)CN1CC(CC#N)(C1)n1ccc(n1)-c1nccc2ncccc12

BDBM538676

FC(F)(F)CN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cc[nH]n1

BDBM538677

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccn[nH]1

BDBM538678

O=S(=O)(C1CC1)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccn[nH]1

BDBM538679

O=S(=O)(C1COC1)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccn[nH]1

BDBM538680

N#CCC1(CC(C1)C#N)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccn[nH]1 |(8.4,5.5,;7,4.88,;5.59,4.25,;4.34,5.16,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,;3.44,3.91,;1.9,3.91,;1.42,2.45,;2.67,1.54,;3.91,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,)|

BDBM538682

N#CCC1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccn[nH]1 |(-.82,10.77,;.38,9.8,;1.57,8.83,;1.33,7.31,;.09,6.4,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;2.24,6.06,;1.9,3.91,;3.44,3.91,;3.91,2.45,;2.67,1.54,;1.42,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,)|

BDBM538684

NC(=O)C1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cc[nH]n1 |(2.32,9.38,;3.76,8.83,;4.96,9.8,;4,7.31,;3.1,6.06,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;5.25,6.4,;3.44,3.91,;1.9,3.91,;1.42,2.45,;2.67,1.54,;3.91,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,)|

BDBM538686

CNC(=O)C1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cc[nH]n1 |(4.72,11.32,;4.96,9.8,;3.76,8.83,;2.32,9.38,;4,7.31,;3.1,6.06,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;5.25,6.4,;3.44,3.91,;1.9,3.91,;1.42,2.45,;2.67,1.54,;3.91,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,)|

BDBM538688

OCC1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccn[nH]1 |(7.98,8.11,;7.78,6.58,;6.35,5.99,;5.77,4.57,;4.34,5.16,;2.82,5.4,;2.27,6.83,;1.72,8.27,;4.93,6.58,;3.44,3.91,;1.9,3.91,;1.42,2.45,;2.67,1.54,;3.91,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,)|

BDBM538690

COC1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccn[nH]1 |(7.98,8.11,;7.78,6.58,;6.35,5.99,;5.77,4.57,;4.34,5.16,;2.82,5.4,;2.27,6.83,;1.72,8.27,;4.93,6.58,;3.44,3.91,;1.9,3.91,;1.42,2.45,;2.67,1.54,;3.91,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,)|

BDBM538692

CC(=O)NC1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cc[nH]n1 |(4.72,11.32,;4.96,9.8,;6.4,9.25,;3.76,8.83,;4,7.31,;3.1,6.06,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;5.25,6.4,;3.44,3.91,;1.9,3.91,;1.42,2.45,;2.67,1.54,;3.91,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,)|

BDBM538693

CN(C1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cc[nH]n1)C(C)=O |(2.32,9.38,;3.76,8.83,;4,7.31,;3.1,6.06,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;5.25,6.4,;3.44,3.91,;1.9,3.91,;1.42,2.45,;2.67,1.54,;3.91,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,;4.96,9.8,;4.72,11.32,;6.4,9.25,)|

BDBM538695

CC1(CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cc[nH]n1)C#N |(4.59,8.73,;4,7.31,;3.1,6.06,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;5.25,6.4,;3.44,3.91,;1.9,3.91,;1.42,2.45,;2.67,1.54,;3.91,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,;3,8.48,;2,9.65,)|

BDBM538697

N#CCC1(CC2(COC2)C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cc[nH]n1

BDBM538698

CC(=O)N1CC2(C1)CC(CC#N)(C2)n1ccc(n1)-c1nc(cc2ncccc12)-c1cc[nH]n1

BDBM538699

CC(C)(O)C1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cc[nH]n1 |(7.19,8,;7.78,6.58,;8.37,5.16,;9.2,7.17,;6.35,5.99,;5.77,4.57,;4.34,5.16,;2.82,5.4,;2.27,6.83,;1.72,8.27,;4.93,6.58,;3.44,3.91,;1.9,3.91,;1.42,2.45,;2.67,1.54,;3.91,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,)|

BDBM538701

Nc1cc(n[nH]1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-3.97,-3.44,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,)|

BDBM538702

Cc1cc(n[nH]1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538703

Cc1cc(n[nH]1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-3.97,-3.44,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,)|

BDBM538705

Cc1cc(n[nH]1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C)(C1)C#N |(-3.97,-3.44,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;4.59,8.73,;5.25,6.4,;3,8.48,;2,9.65,)|

BDBM538707

CCN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cc(CO)[nH]n1

BDBM538708

OCc1cc(n[nH]1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-4.87,-4.68,;-3.97,-3.44,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,)|

BDBM538710

COC1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cc(CO)n[nH]1 |(.38,9.8,;1.57,8.83,;1.33,7.31,;.09,6.4,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;2.24,6.06,;1.9,3.91,;3.44,3.91,;3.91,2.45,;2.67,1.54,;1.42,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;-2.29,-6.34,;-3.83,-6.5,;-2.44,-3.6,;-1.41,-2.45,)|

BDBM538712

COC1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cc(N)[nH]n1 |(.38,9.8,;1.57,8.83,;1.33,7.31,;.09,6.4,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;2.24,6.06,;1.9,3.91,;3.44,3.91,;3.91,2.45,;2.67,1.54,;1.42,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-3.97,-3.44,;-1.67,-4.93,;-.16,-4.61,)|

BDBM538714

Cn1nccc1-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538715

Cn1ccc(n1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538716

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccn(n1)C1COC1

BDBM538717

FC(F)(F)CN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccn(n1)C1COC1

BDBM538718

Cc1cc(nn1C)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-3.97,-3.44,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;-2.29,-6.34,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,)|

BDBM538720

Cn1nc(CO)cc1-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-1.73,-.95,;-1.41,-2.45,;-2.44,-3.6,;-1.67,-4.93,;-2.29,-6.34,;-1.39,-7.58,;-.16,-4.61,;,-3.08,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,)|

BDBM538722

Cn1nc(cc1CO)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-2.29,-6.34,;-1.67,-4.93,;-.16,-4.61,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-3.97,-3.44,;-4.87,-4.68,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,)|

BDBM538724

CCN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cc(N)n(C)n1

BDBM538725

Cn1nc(cc1N)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-2.29,-6.34,;-1.67,-4.93,;-.16,-4.61,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-3.97,-3.44,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,)|

BDBM538727

Cn1nc(cc1N)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C)(C1)C#N |(-2.29,-6.34,;-1.67,-4.93,;-.16,-4.61,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-3.97,-3.44,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.33,8.48,;2.24,6.06,;.74,8.73,;.15,10.15,)|

BDBM538729

CNc1cc(nn1C)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-4.87,-4.68,;-3.97,-3.44,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;-2.29,-6.34,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,)|

BDBM538731

Cn1nc(cc1CN)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-2.29,-6.34,;-1.67,-4.93,;-.16,-4.61,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-3.97,-3.44,;-4.87,-4.68,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,)|

BDBM538732

N#CCC1(CC(C1)C#N)n1ccc(n1)-c1nc(cc2ncccc12)-c1cc2CNCCn2n1 |(-6.41,-6.97,;-4.88,-7.13,;-3.35,-7.29,;-2.72,-8.7,;-2.09,-10.1,;-3.5,-10.73,;-4.13,-9.32,;-4.05,-12.17,;-4.6,-13.6,;-1.31,-8.07,;.02,-8.84,;1.17,-7.81,;.54,-6.4,;-.99,-6.56,;1.31,-5.07,;2.85,-5.07,;3.62,-3.74,;2.85,-2.4,;1.31,-2.4,;.54,-1.07,;-1,-1.07,;-1.77,-2.4,;-1,-3.74,;.54,-3.74,;5.16,-3.74,;6.06,-2.49,;7.53,-2.97,;8.86,-2.2,;10.2,-2.97,;10.2,-4.51,;8.86,-5.28,;7.53,-4.51,;6.06,-4.98,)|

BDBM538734

FC(F)(F)CN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cn[nH]c1

BDBM538735

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cn[nH]c1

BDBM538736

N#CCC1(CC(C1)C#N)n1ccc(n1)-c1nc(cc2ncccc12)-c1cn[nH]c1 |(8.4,5.5,;7,4.88,;5.59,4.25,;4.34,5.16,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,;3.44,3.91,;1.9,3.91,;1.42,2.45,;2.67,1.54,;3.91,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,)|

BDBM538738

N#CCC1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cn[nH]c1 |(-.82,10.77,;.38,9.8,;1.57,8.83,;1.33,7.31,;.09,6.4,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;2.24,6.06,;1.9,3.91,;3.44,3.91,;3.91,2.45,;2.67,1.54,;1.42,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,)|

BDBM538740

COC1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cn[nH]c1 |(7.98,8.11,;7.78,6.58,;6.35,5.99,;5.77,4.57,;4.34,5.16,;2.82,5.4,;2.27,6.83,;1.72,8.27,;4.93,6.58,;3.44,3.91,;1.9,3.91,;1.42,2.45,;2.67,1.54,;3.91,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,)|

BDBM538742

CC(C)(O)C1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cn[nH]c1 |(7.19,8,;7.78,6.58,;8.37,5.16,;9.2,7.17,;6.35,5.99,;5.77,4.57,;4.34,5.16,;2.82,5.4,;2.27,6.83,;1.72,8.27,;4.93,6.58,;3.44,3.91,;1.9,3.91,;1.42,2.45,;2.67,1.54,;3.91,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,)|

BDBM538743

CC1(CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cn[nH]c1)C#N |(4.59,8.73,;4,7.31,;3.1,6.06,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;5.25,6.4,;3.44,3.91,;1.9,3.91,;1.42,2.45,;2.67,1.54,;3.91,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,;3,8.48,;2,9.65,)|

BDBM538745

N#CCC1(CC(C1)c1ccn[nH]1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cn[nH]c1 |(1.72,8.27,;2.27,6.83,;2.82,5.4,;4.34,5.16,;5.77,4.57,;6.35,5.99,;4.93,6.58,;7.78,6.58,;9.09,5.77,;10.26,6.77,;9.67,8.2,;8.14,8.08,;3.44,3.91,;1.9,3.91,;1.42,2.45,;2.67,1.54,;3.91,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,)|

BDBM538746

Cn1nccc1C1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cn[nH]c1 |(7.14,9.25,;8.14,8.08,;9.67,8.2,;10.26,6.77,;9.09,5.77,;7.78,6.58,;6.35,5.99,;5.77,4.57,;4.34,5.16,;2.82,5.4,;2.27,6.83,;1.72,8.27,;4.93,6.58,;3.44,3.91,;1.9,3.91,;1.42,2.45,;2.67,1.54,;3.91,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,)|

BDBM538747

Cc1n[nH]cc1-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538748

Cc1n[nH]cc1-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(.98,-5.64,;-.16,-4.61,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,)|

BDBM538750

OCc1[nH]ncc1-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-3.19,-.47,;-1.73,-.95,;-1.41,-2.45,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,;,-3.08,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,)|

BDBM538752

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1c[nH]nc1N

BDBM538753

CCN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1c[nH]nc1N

BDBM538754

COC1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1c[nH]nc1N |(.38,9.8,;1.57,8.83,;1.33,7.31,;.09,6.4,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;2.24,6.06,;1.9,3.91,;3.44,3.91,;3.91,2.45,;2.67,1.54,;1.42,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,;.98,-5.64,)|

BDBM538756

Nc1n[nH]cc1-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(.98,-5.64,;-.16,-4.61,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,)|

BDBM538758

Cn1cc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538759

Cn1cc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC#N)C1

BDBM538760

Cn1cc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC2CC2)C1

BDBM538761

Cn1cc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-3.97,-3.44,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,)|

BDBM538763

Cn1cc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538764

CCS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn(C)c1

BDBM538765

CCCS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn(C)c1

BDBM538766

Cn1cc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(=O)(=O)C1CC1

BDBM538767

Cn1cc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(N)(=O)=O

BDBM538768

CNS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn(C)c1

BDBM538769

COC1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn(C)c1 |(7.98,8.11,;7.78,6.58,;6.35,5.99,;5.77,4.57,;4.34,5.16,;2.82,5.4,;2.27,6.83,;1.72,8.27,;4.93,6.58,;3.44,3.91,;1.9,3.91,;1.42,2.45,;2.67,1.54,;3.91,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;-2.44,-3.6,;-3.97,-3.44,;-1.41,-2.45,)|

BDBM538770

CCn1cc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538771

CCn1cc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-4.87,-4.68,;-3.97,-3.44,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,)|

BDBM538773

CN(C)CCn1cc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-7.31,-5.77,;-6.41,-4.52,;-7.03,-3.12,;-4.87,-4.68,;-3.97,-3.44,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,)|

BDBM538774

FC(F)(F)CN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn(c1)C1CNC1

BDBM538775

FC(F)(F)CN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn(c1)C1CCNCC1

BDBM538776

CN1CCC(CC1)n1cc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538777

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn(c1)C(F)(F)F

BDBM538778

FC(F)(F)CN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn(c1)C1COC1

BDBM538779

N#CCN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn(c1)C1COC1

BDBM538780

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn(c1)C1COC1

BDBM538781

COC1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn(c1)C1COC1 |(7.98,8.11,;7.78,6.58,;6.35,5.99,;5.77,4.57,;4.34,5.16,;2.82,5.4,;2.27,6.83,;1.72,8.27,;4.93,6.58,;3.44,3.91,;1.9,3.91,;1.42,2.45,;2.67,1.54,;3.91,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,;-3.97,-3.44,;-5.17,-4.41,;-6.13,-3.21,;-4.94,-2.24,)|

BDBM538782

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn(c1)[C@H]1CCOC1

BDBM538783

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn(c1)[C@@H]1CCOC1

BDBM538784

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn(CCO)c1

BDBM538785

OCCn1cc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-6.13,-1.87,;-4.6,-2.03,;-3.97,-3.44,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,)|

BDBM538787

COC1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn(CCO)c1 |(.38,9.8,;1.57,8.83,;1.33,7.31,;.09,6.4,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;2.24,6.06,;1.9,3.91,;3.44,3.91,;3.91,2.45,;2.67,1.54,;1.42,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-1.67,-4.93,;-2.29,-6.34,;-3.83,-6.5,;-4.45,-7.91,;-.16,-4.61,)|

BDBM538789

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn(c1)C(CO)CCl

BDBM538790

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn(c1)C(=C)CO

BDBM538791

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn(CC2COC2)c1

BDBM538792

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn(CC2(O)COC2)c1

BDBM538793

Cn1ncc(c1C(N)=O)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538794

Cn1cc(c(CO)n1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-3.97,-3.44,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;.98,-5.64,;.66,-7.15,;-1.67,-4.93,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,)|

BDBM538795

Cn1ncc(c1CO)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-3.97,-3.44,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,;,-3.08,;-1.41,-2.45,;-1.73,-.95,;-3.19,-.47,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,)|

BDBM538796

Cn1ncc(c1N)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538797

Cn1cc(c(N)n1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538798

Cn1cc(c(N)n1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-3.97,-3.44,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;.98,-5.64,;-1.67,-4.93,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,)|

BDBM538800

Cn1ncc(c1N)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-3.97,-3.44,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,;,-3.08,;-1.41,-2.45,;-1.73,-.95,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,)|

BDBM538802

Cc1ccn(n1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538803

FC(F)(F)CN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cn(cn1)C1COC1

BDBM538804

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnco1

BDBM538805

OCc1cc(on1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-1.39,-7.58,;-2.29,-6.34,;-1.67,-4.93,;-.16,-4.61,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,)|

BDBM538806

Cc1onc(N)c1-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538807

FC(F)(F)CN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ncc[nH]1

BDBM538808

Cn1cnc(c1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538809

Cc1nc(c[nH]1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538810

Cc1nc(cn1C)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538811

Cc1ncc(-c2cc3ncccc3c(n2)-c2ccn(n2)C2(CC#N)CN(CC(F)(F)F)C2)n1C

BDBM538812

FC(F)(F)CN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cn[nH]n1

BDBM538813

Cn1ncc(n1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538814

FC(F)(F)CN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn(n1)C1CCCCO1

BDBM538815

OCc1csc(n1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-4.87,-4.68,;-3.97,-3.44,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,;,-3.08,;-1.41,-2.45,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,)|

BDBM538816

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1c[nH]c2nccc2c1

BDBM538817

FC(F)(F)CN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnc2cc[nH]c2c1

BDBM538818

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1c[nH]c2ncccc12

BDBM538819

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1c[nH]c2cccnc12

BDBM538820

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn2ccccc12

BDBM538821

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccc2nccn2c1

BDBM538822

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccn2ccnc2c1

BDBM538823

Cn1cnc2cc(cnc12)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538824

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnc2nccn2c1

BDBM538825

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnc2cn[nH]c2c1

BDBM538826

FC(F)(F)CN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccc2nncn2c1

BDBM538827

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnn2cccnc12

BDBM538828

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnc2[nH]c(=O)[nH]c2c1

BDBM538829

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnc2NCCNc2c1

BDBM538830

FC(F)(F)CN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cccnc1

BDBM538831

FC(F)(F)CN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccncc1

BDBM538832

Cc1cncc(c1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538833

Cc1cc(ccn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538834

Cc1ccc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538835

Cc1cc(ccn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538836

Cc1ccc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538837

Fc1cncc(c1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538838

Fc1cnccc1-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538839

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cccc(O)n1

BDBM538840

Oc1cccc(n1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-1.33,-6.93,;-1.33,-5.39,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,)|

BDBM538842

Oc1ccc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538843

CCN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccc(O)nc1

BDBM538844

Oc1ccc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)C1CC(F)(F)C1

BDBM538845

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccnc(O)c1

BDBM538846

COc1ncccc1-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538847

COc1ccc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538848

COc1cc(ccn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538849

Nc1ccc(nc1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-4,-5.39,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;-1.33,-5.39,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,)|

BDBM538850

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cccnc1N

BDBM538851

Nc1ccc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538852

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cncc(N)c1

BDBM538853

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccc(N)nc1

BDBM538854

Nc1ccc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-4,-5.39,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;-1.33,-5.39,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,)|

BDBM538856

Nc1cc(ccn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538857

Nc1cc(ccn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-1.33,-6.93,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,)|

BDBM538859

CC1(CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccnc(N)c1)C#N |(2.33,8.48,;1.33,7.31,;.09,6.4,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;2.24,6.06,;1.9,3.91,;3.44,3.91,;3.91,2.45,;2.67,1.54,;1.42,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-1.33,-6.93,;,-4.62,;.74,8.73,;.15,10.15,)|

BDBM538861

CCOC(=O)Nc1cncc(c1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538862

CN(C)c1ccc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538863

CS(=O)(=O)Nc1cncc(c1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538864

CS(=O)(=O)Nc1ccc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538865

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccc(nc1)S(C)(=O)=O

BDBM538866

CS(=O)(=O)c1ccc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-3.23,-6.72,;-4,-5.39,;-5.33,-6.16,;-4.77,-4.06,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;-1.33,-5.39,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,)|

BDBM538868

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccc(nc1)S(N)(=O)=O

BDBM538869

NS(=O)(=O)c1ccc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-3.23,-6.72,;-4,-5.39,;-5.33,-6.16,;-4.77,-4.06,;-2.67,-4.62,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.04,3.78,;6.58,3.7,;8.12,3.62,;5.51,6.16,;4.51,7.33,;3.34,6.33,;4.63,8.86,;4.76,10.4,)|

BDBM538871

OCc1cccc(n1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(,-7.7,;-1.33,-6.93,;-1.33,-5.39,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,)|

BDBM538872

OCc1cc(ccn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(,-7.7,;-1.33,-6.93,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,)|

BDBM538873

NC(=O)c1cccc(n1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-4,-.77,;-4,-2.31,;-5.33,-3.08,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.04,3.78,;6.58,3.7,;8.12,3.62,;5.51,6.16,;4.51,7.33,;3.34,6.33,;4.63,8.86,;4.76,10.4,)|

BDBM538874

NC(=O)c1cc(ccn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538875

NC(=O)c1cc(ccn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-2.67,-7.7,;-1.33,-6.93,;,-7.7,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.04,3.78,;6.58,3.7,;8.12,3.62,;5.51,6.16,;4.51,7.33,;3.34,6.33,;4.63,8.86,;4.76,10.4,)|

BDBM538876

Cc1ncc(cc1N)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538877

Cc1ccc(c(N)n1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538878

Cc1cc(cnc1N)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538879

Cc1cc(cc(N)n1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-4,-2.31,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;-1.33,-5.39,;-1.33,-6.93,;-2.67,-4.62,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,)|

BDBM538881

Cc1ncc(cc1O)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538882

COc1nc(ccc1N)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-2.67,-7.7,;-1.33,-6.93,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-4,-5.39,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,)|

BDBM538883

NC(=O)c1nc(ccc1N)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-5.33,-3.08,;-4,-2.31,;-4,-.77,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;-1.33,-5.39,;-2.67,-4.62,;-4,-5.39,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,)|

BDBM538886

CC(=O)Nc1cc(cnc1C)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538887

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnc(N)c(N)c1

BDBM538888

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccc(N)nc1N

BDBM538889

CC(=O)Nc1cc(cnc1NC(C)=O)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538890

FC(F)(F)CN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnc2CCCc2c1

BDBM538891

FC(F)(F)CN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccnnc1

BDBM538892

FC(F)(F)CN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cncnc1

BDBM538893

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cncnc1

BDBM538894

COc1ncc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538895

COc1ncc(cn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538896

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cnc(N)nc1

BDBM538897

Nc1cc(cnn1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-4,-2.31,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;-1.33,-5.39,;-2.67,-4.62,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,)|

BDBM538899

Nc1cnnc(c1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-4,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,)|

BDBM538901

NC(=O)c1nccc(n1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-2.67,-7.7,;-1.33,-6.93,;,-7.7,;-1.33,-5.39,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.04,3.78,;6.58,3.7,;8.12,3.62,;5.51,6.16,;4.51,7.33,;3.34,6.33,;4.63,8.86,;4.76,10.4,)|

BDBM538903

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccc(=O)[nH]c1

BDBM538904

O=c1ccc(c[nH]1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(=O)(=O)C1CC1

BDBM538905

COC1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccc(=O)[nH]c1 |(7.98,8.11,;7.78,6.58,;6.35,5.99,;5.77,4.57,;4.34,5.16,;2.82,5.4,;2.27,6.83,;1.72,8.27,;4.93,6.58,;3.44,3.91,;1.9,3.91,;1.42,2.45,;2.67,1.54,;3.91,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-4,-5.39,;-1.33,-5.39,;,-4.62,)|

BDBM538906

Cn1cc(ccc1=O)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538907

Cn1cc(ccc1=O)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538908

Cc1cc(c[nH]c1=O)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538909

CCn1cc(ccc1=O)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CN(C1)S(C)(=O)=O

BDBM538910

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccccc1O

BDBM538911

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccc(O)cc1

BDBM538912

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccccc1CO

BDBM538913

CS(=O)(=O)Nc1ccc(cc1)-c1cc2ncccc2c(n1)-c1ccn(n1)C1(CC#N)CC(C1)C#N |(-2.46,-6.93,;-4,-6.93,;-4,-8.47,;-5.54,-6.93,;-4,-5.39,;-2.67,-4.62,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;5.04,3.78,;6.58,3.7,;8.12,3.62,;5.51,6.16,;4.51,7.33,;3.34,6.33,;4.63,8.86,;4.76,10.4,)|

BDBM538915

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccccc1F

BDBM538916

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccc(F)cc1O

BDBM538917

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1ccc(O)c(F)c1

BDBM538918

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cc(O)cc(F)c1

BDBM538919

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)-c1cc(F)ccc1O

BDBM538920

CCN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)C1=CCOCC1 |t:28|

BDBM538921

CCN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)N1CCOCC1

BDBM538922

CCN1CC(CC#N)(C1)n1ccc(n1)-c1nc(cc2ncccc12)N1CCCC1

BDBM538923

Nc1cccc(Oc2cc3ncccc3c(n2)-c2ccn(n2)C2(CC#N)CC(C2)C#N)n1 |(2.67,-7.7,;1.33,-6.93,;,-7.7,;-1.33,-6.93,;-1.33,-5.39,;,-4.62,;,-3.08,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;1.33,-5.39,)|

BDBM538924

Cc1cc(nn1C1(CC#N)CN(C1)S(C)(=O)=O)-c1nc(cc2ncccc12)-c1ccn[nH]1

BDBM538925

Cc1cc(nn1C1(CC#N)CC(C1)C#N)-c1nc(cc2ncccc12)-c1cc[nH]n1 |(.99,5.16,;1.9,3.91,;1.42,2.45,;2.67,1.54,;3.91,2.45,;3.44,3.91,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,)|

BDBM538927

Cc1cc(nn1C1(CC#N)CC(C1)C#N)-c1nc(cc2ncccc12)-c1cc(N)n(C)n1 |(4.34,5.16,;3.44,3.91,;3.91,2.45,;2.67,1.54,;1.42,2.45,;1.9,3.91,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-3.97,-3.44,;-1.67,-4.93,;-2.29,-6.34,;-.16,-4.61,)|

BDBM538929

Cc1cc(nn1C1(CC#N)CN(C1)S(C)(=O)=O)-c1nc(cc2ncccc12)-c1cn[nH]c1

BDBM538930

Cc1cc(nn1C1(CC#N)CC(C1)C#N)-c1nc(cc2ncccc12)-c1cn[nH]c1 |(.99,5.16,;1.9,3.91,;1.42,2.45,;2.67,1.54,;3.91,2.45,;3.44,3.91,;4.34,5.16,;5.59,4.25,;7,4.88,;8.4,5.5,;3.1,6.06,;4,7.31,;5.25,6.4,;3.76,8.83,;3.52,10.35,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,)|

BDBM538932

Cc1cc(nn1C1(CC#N)CC(C1)C#N)-c1nc(cc2ncccc12)-c1cn[nH]c1N |(4.34,5.16,;3.44,3.91,;3.91,2.45,;2.67,1.54,;1.42,2.45,;1.9,3.91,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,;-1.73,-.95,)|

BDBM538933

Cc1cn(nc1-c1nc(cc2ncccc12)-c1cn[nH]c1N)C1(CC#N)CC(C1)C#N |(5.38,1.97,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;2.67,1.54,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,;-1.73,-.95,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,)|

BDBM538934

Cc1cn(nc1-c1nc(cc2ncccc12)-c1cc(N)n(C)n1)C1(CC#N)CC(C1)C#N |(5.38,1.97,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;2.67,1.54,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-3.97,-3.44,;-1.67,-4.93,;-2.29,-6.34,;-.16,-4.61,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,)|

BDBM538936

Cn1cc(cn1)-c1cc2ncccc2c(n1)-n1ccc(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538937

Cn1cc(cn1)-c1cc2ncccc2c(n1)-c1cn(nn1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM538938

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1nc(cc2ncccc12)-c1cc[nH]n1

BDBM538939

Cn1cc(cn1)-c1cc2ncccc2c(n1)-c1cc(no1)C1(CC#N)CN(CC#N)C1

BDBM538940

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1cc(cc2ncccc12)-c1cc[nH]n1

BDBM538941

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1cc(cc2ncccc12)-c1cn[nH]c1

BDBM538942

Cn1cc(cn1)-c1cc(-c2ccn(n2)C2(CC#N)CN(CC(F)(F)F)C2)c2cccnc2c1

BDBM538943

Cn1cc(cn1)-c1cc(-c2ccn(n2)C2(CC#N)CN(C2)S(C)(=O)=O)c2cccnc2c1

BDBM538944

CS(=O)(=O)N1CC(CC#N)(C1)n1ccc(n1)-c1cc(cc2ncccc12)-c1ccc(=O)[nH]c1

BDBM538945

CS(=O)(=O)N1CC(CC#N)(C1)n1cc(cn1)-c1cc(cc2ncccc12)-c1cc[nH]n1

BDBM538946

CS(=O)(=O)N1CC(CC#N)(C1)n1cc(cn1)-c1cc(cc2ncccc12)-c1cn[nH]c1

BDBM538947

Nc1[nH]ncc1-c1cc(-c2cnn(c2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-1.73,-.95,;-1.41,-2.45,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,;,-3.08,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;1.42,2.45,;1.9,3.91,;3.44,3.91,;3.91,2.45,;4.34,5.16,;3.1,6.06,;3.26,7.59,;3.42,9.12,;5.25,6.4,;6.49,5.5,;5.59,4.25,;8.01,5.74,;9.54,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM538948

COC1CC(CC#N)(C1)n1cc(cn1)-c1cc(cc2ncccc12)-c1c[nH]nc1N

BDBM538949

Cn1cc(cn1)-c1cc(-c2cnn(c2)C2(CC#N)CN(CC#N)C2)c2cccnc2c1

BDBM538950

Cc1cc(nn1C1(CC#N)CN(C1)S(C)(=O)=O)-c1cc(cc2ncccc12)-c1cc[nH]n1

BDBM538951

Cn1cc(cn1)-c1cc(-c2cn(nn2)C2(CC#N)CN(C2)S(C)(=O)=O)c2cccnc2c1

BDBM538952

CS(=O)(=O)N1CC(CC#N)(C1)n1cc(nn1)-c1cc(cc2ncccc12)-c1ccc(=O)[nH]c1

BDBM538953

FC(F)(F)CN1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1cc[nH]n1

BDBM538954

FC1(CN2CC(CC#N)(C2)n2ncc(n2)-c2cc(cc3ncccc23)-c2cc[nH]n2)CC1

BDBM538955

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1cc[nH]n1

BDBM538956

O=S(=O)(C1CC1)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1cc[nH]n1

BDBM538957

NS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1cc[nH]n1

BDBM538958

O=S(=O)(C1COC1)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1ccn[nH]1

BDBM538959

N#CCC1(CC(C1)C#N)n1ncc(n1)-c1cc(cc2ncccc12)-c1cc[nH]n1 |(1.92,9.12,;2.08,7.59,;2.24,6.06,;.99,5.16,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;1.9,3.91,;3.44,3.91,;3.91,2.45,;2.67,1.54,;1.42,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,)|

BDBM538961

COC1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1cc[nH]n1 |(-.69,9.53,;.7,8.86,;.82,7.33,;1.99,6.33,;.99,5.16,;.29,3.78,;-1.24,3.7,;-2.78,3.62,;-.18,6.16,;1.9,3.91,;3.44,3.91,;3.91,2.45,;2.67,1.54,;1.42,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,)|

BDBM538963

Nc1cc(n[nH]1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-3.97,-3.44,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM538965

OCc1cc(n[nH]1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-4.87,-4.68,;-3.97,-3.44,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM538966

Cn1nc(cc1CO)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-2.29,-6.34,;-1.67,-4.93,;-.16,-4.61,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-3.97,-3.44,;-4.87,-4.68,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM538967

Cn1nccc1-c1cc(-c2cnn(n2)C2(CC#N)CN(C2)S(C)(=O)=O)c2cccnc2c1

BDBM538968

Cn1ccc(n1)-c1cc(-c2cnn(n2)C2(CC#N)CN(C2)S(C)(=O)=O)c2cccnc2c1

BDBM538969

Cn1ccc(n1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-2.29,-6.34,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM538971

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1cn[nH]c1

BDBM538972

N#CCC1(CC(C1)C#N)n1ncc(n1)-c1cc(cc2ncccc12)-c1cn[nH]c1 |(1.92,9.12,;2.08,7.59,;2.24,6.06,;.99,5.16,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;1.9,3.91,;3.44,3.91,;3.91,2.45,;2.67,1.54,;1.42,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,)|

BDBM538974

OCc1n[nH]cc1-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(2.45,-5.17,;.98,-5.64,;-.16,-4.61,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM538976

Nc1[nH]ncc1-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-1.73,-.95,;-1.41,-2.45,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,;,-3.08,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM538978

CC1(CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1c[nH]nc1N)C#N |(2.33,8.48,;1.33,7.31,;.09,6.4,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;2.24,6.06,;1.9,3.91,;3.44,3.91,;3.91,2.45,;2.67,1.54,;1.42,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,;.98,-5.64,;.74,8.73,;.15,10.15,)|

BDBM538979

CC1(CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1cn[nH]c1N)C#N |(2.33,8.48,;1.33,7.31,;.09,6.4,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;2.24,6.06,;1.9,3.91,;3.44,3.91,;3.91,2.45,;2.67,1.54,;1.42,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,;-1.73,-.95,;.74,8.73,;.15,10.15,)|

BDBM538980

Cn1cc(cn1)-c1cc(-c2cnn(n2)C2(CC#N)CN(C2)S(C)(=O)=O)c2cccnc2c1

BDBM538981

Cn1cc(cn1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-3.97,-3.44,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM538983

OCCn1cc(cn1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-6.13,-1.87,;-4.6,-2.03,;-3.97,-3.44,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM538985

Cn1ncc(c1CO)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-3.97,-3.44,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,;,-3.08,;-1.41,-2.45,;-1.73,-.95,;-3.19,-.47,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM538986

Cn1cc(c(CO)n1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-3.97,-3.44,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;.98,-5.64,;.66,-7.15,;-1.67,-4.93,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM538987

Cn1ncc(c1N)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-3.97,-3.44,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,;,-3.08,;-1.41,-2.45,;-1.73,-.95,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM538989

Cn1cc(c(N)n1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-3.97,-3.44,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;.98,-5.64,;-1.67,-4.93,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM538991

Cn1ncc(c1C(N)=O)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-3.97,-3.44,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,;,-3.08,;-1.41,-2.45,;-1.73,-.95,;-.58,.08,;-3.19,-.47,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.51,5.4,;3.07,6.83,;3.62,8.27,;.4,6.58,;-1.02,5.99,;-.43,4.57,;-2.44,6.58,;-3.87,7.17,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM538993

Cc1nc(c[nH]1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-2.29,-6.34,;-1.67,-4.93,;-.16,-4.61,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM538995

Cn1nncc1-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-1.73,-.95,;-1.41,-2.45,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,;,-3.08,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM538996

Cn1cc(nn1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-3.97,-3.44,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;-1.67,-4.93,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM538997

OCc1csc(n1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-4.87,-4.68,;-3.97,-3.44,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,;,-3.08,;-1.41,-2.45,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM538999

OCc1ncc(s1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-4.87,-4.68,;-3.97,-3.44,;-2.44,-3.6,;-1.67,-4.93,;-.16,-4.61,;,-3.08,;-1.41,-2.45,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539000

OCc1cnc(s1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-1.39,-7.58,;-2.29,-6.34,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;-.16,-4.61,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539001

OCc1ncsc1-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(2.45,-5.17,;.98,-5.64,;-.16,-4.61,;-1.67,-4.93,;-2.44,-3.6,;-1.41,-2.45,;,-3.08,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539002

OCc1cc(sn1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-1.39,-7.58,;-2.29,-6.34,;-1.67,-4.93,;-.16,-4.61,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539003

N#CCC1(CC(C1)C#N)n1ncc(n1)-c1cc(cc2ncccc12)-c1ccccn1 |(1.92,9.12,;2.08,7.59,;2.24,6.06,;.99,5.16,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;1.9,3.91,;3.44,3.91,;3.91,2.45,;2.67,1.54,;1.42,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;,-4.62,)|

BDBM539004

Fc1ccc(nc1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-4,-5.39,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;-1.33,-5.39,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539006

NC(=O)c1cccc(n1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-4,-.77,;-4,-2.31,;-5.33,-3.08,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.51,5.4,;3.07,6.83,;3.62,8.27,;.4,6.58,;-1.02,5.99,;-.43,4.57,;-2.44,6.58,;-3.87,7.17,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539008

NC(=O)c1ccc(nc1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-5.33,-4.62,;-4,-5.39,;-4,-6.93,;-2.67,-4.62,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.51,5.4,;3.07,6.83,;3.62,8.27,;.4,6.58,;-1.02,5.99,;-.43,4.57,;-2.44,6.58,;-3.87,7.17,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539010

NC(=O)c1ccnc(c1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-4,-.77,;-4,-2.31,;-5.33,-3.08,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.51,5.4,;3.07,6.83,;3.62,8.27,;.4,6.58,;-1.02,5.99,;-.43,4.57,;-2.44,6.58,;-3.87,7.17,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539012

Cc1ccc(cn1)-c1cc(-c2cnn(n2)C2(CC#N)CN(C2)S(C)(=O)=O)c2cccnc2c1

BDBM539013

Cc1cc(ccn1)-c1cc(-c2cnn(n2)C2(CC#N)CN(C2)S(C)(=O)=O)c2cccnc2c1

BDBM539014

Nc1cccc(n1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-1.33,-6.93,;-1.33,-5.39,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539016

Nc1ccc(nc1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-4,-5.39,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;-1.33,-5.39,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539019

Nc1ncccc1-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(1.33,-5.39,;,-4.62,;-1.33,-5.39,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539021

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1ccc(N)nc1

BDBM539022

Nc1ccc(cn1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-4,-5.39,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;-1.33,-5.39,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539024

Nc1cc(ccn1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-1.33,-6.93,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539025

CS(=O)(=O)c1ccc(nc1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-3.23,-6.72,;-4,-5.39,;-5.33,-6.16,;-4.77,-4.06,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;-1.33,-5.39,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539027

OC(=O)c1cccc(n1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-4,-.77,;-4,-2.31,;-5.33,-3.08,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.51,5.4,;3.07,6.83,;3.62,8.27,;.4,6.58,;-1.02,5.99,;-.43,4.57,;-2.44,6.58,;-3.87,7.17,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539029

CS(=O)(=O)Nc1cccc(n1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-4.56,-4.41,;-5.33,-3.08,;-6.67,-3.85,;-6.1,-1.75,;-4,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.51,5.4,;3.07,6.83,;3.62,8.27,;.4,6.58,;-1.02,5.99,;-.43,4.57,;-2.44,6.58,;-3.87,7.17,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539031

CS(=O)(=O)Nc1ccc(nc1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-2.46,-6.93,;-4,-6.93,;-4,-8.47,;-5.54,-6.93,;-4,-5.39,;-2.67,-4.62,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.51,5.4,;3.07,6.83,;3.62,8.27,;.4,6.58,;-1.02,5.99,;-.43,4.57,;-2.44,6.58,;-3.87,7.17,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539033

CC(=O)Nc1cccc(n1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-5.33,,;-4,-.77,;-2.67,,;-4,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.51,5.4,;3.07,6.83,;3.62,8.27,;.4,6.58,;-1.02,5.99,;-.43,4.57,;-2.44,6.58,;-3.87,7.17,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539035

Cc1nc(ccc1CCO)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-1.33,-6.93,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-4,-5.39,;-5.33,-4.62,;-6.67,-5.39,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539037

N#CCC1(CC(C1)C#N)n1ncc(n1)-c1cc(cc2ncccc12)-c1cc2NCCc2cn1 |(24.32,-.18,;23.07,-1.08,;21.82,-1.99,;20.42,-1.36,;19.01,-.74,;19.64,.67,;21.04,.05,;19.09,2.11,;18.53,3.55,;19.79,-2.77,;20.56,-4.1,;19.53,-5.25,;18.12,-4.62,;18.28,-3.09,;16.79,-5.39,;15.46,-4.62,;14.12,-5.39,;14.12,-6.93,;15.46,-7.7,;15.46,-9.24,;16.79,-10.01,;18.12,-9.24,;18.12,-7.7,;16.79,-6.93,;12.79,-4.62,;11.46,-5.39,;10.12,-4.62,;8.66,-5.1,;7.75,-3.85,;8.66,-2.6,;10.12,-3.08,;11.46,-2.31,;12.79,-3.08,)|

BDBM539038

Cc1nc(ccc1O)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-1.33,-6.93,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-4,-5.39,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539040

COc1nc(ccc1N)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-2.67,-7.7,;-1.33,-6.93,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-4,-5.39,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539042

NC(=O)c1cc(ncc1F)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-4,-.77,;-4,-2.31,;-5.33,-3.08,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;-1.33,-5.39,;-2.67,-4.62,;-4,-5.39,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.51,5.4,;3.07,6.83,;3.62,8.27,;.4,6.58,;-1.02,5.99,;-.43,4.57,;-2.44,6.58,;-3.87,7.17,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539043

Cc1cc(cnc1N)-c1cc(-c2cnn(n2)C2(CC#N)CN(C2)S(C)(=O)=O)c2cccnc2c1

BDBM539044

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1cncnc1

BDBM539045

N#CCC1(CC(C1)C#N)n1ncc(n1)-c1cc(cc2ncccc12)-c1ncccn1 |(1.92,9.12,;2.08,7.59,;2.24,6.06,;.99,5.16,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;1.9,3.91,;3.44,3.91,;3.91,2.45,;2.67,1.54,;1.42,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;,-4.62,;-1.33,-5.39,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,)|

BDBM539046

N#CCC1(CC(C1)C#N)n1ncc(n1)-c1cc(cc2ncccc12)-c1cncnc1 |(1.92,9.12,;2.08,7.59,;2.24,6.06,;.99,5.16,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;1.9,3.91,;3.44,3.91,;3.91,2.45,;2.67,1.54,;1.42,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;,-4.62,;-1.33,-5.39,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,)|

BDBM539047

N#CCC1(CC(C1)C#N)n1ncc(n1)-c1cc(cc2ncccc12)-c1cnccn1 |(1.92,9.12,;2.08,7.59,;2.24,6.06,;.99,5.16,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;1.9,3.91,;3.44,3.91,;3.91,2.45,;2.67,1.54,;1.42,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;,-4.62,)|

BDBM539048

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1cnc(N)nc1

BDBM539049

Nc1ncc(cn1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-4,-5.39,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;-1.33,-5.39,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539050

Nc1cc(ncn1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-4,-2.31,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;-1.33,-5.39,;-2.67,-4.62,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539051

Nc1cncc(n1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-1.33,-6.93,;-1.33,-5.39,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539053

Nc1cnc(cn1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-4,-5.39,;-2.67,-4.62,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539055

Nc1ccc(nn1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-4,-5.39,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;-1.33,-5.39,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539057

Cc1cncc(n1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-1.33,-6.93,;-1.33,-5.39,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539059

Cc1ncc(N)nc1-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-1.33,-.77,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-1.33,-6.93,;,-4.62,;,-3.08,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539060

COc1ncc(cn1)-c1cc(-c2cnn(n2)C2(CC#N)CN(C2)S(C)(=O)=O)c2cccnc2c1

BDBM539061

OCCOc1cnc(nc1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-5.33,-9.24,;-5.33,-7.7,;-4,-6.93,;-4,-5.39,;-2.67,-4.62,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539062

COc1nc(cnc1N)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-2.67,-7.7,;-1.33,-6.93,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-4,-5.39,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539063

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1ccc(=O)[nH]c1

BDBM539064

O=c1cc(cc[nH]1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-1.33,-6.93,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.24,6.06,;2.08,7.59,;1.92,9.12,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539066

Cn1cc(ccc1=O)-c1cc(-c2cnn(n2)C2(CC#N)CN(C2)S(C)(=O)=O)c2cccnc2c1

BDBM539067

CCn1cc(ccc1=O)-c1cc(-c2cnn(n2)C2(CC#N)CN(C2)S(C)(=O)=O)c2cccnc2c1

BDBM539068

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1c[nH]c(=O)[nH]c1=O

BDBM539069

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1c[nH]c2nccc2c1

BDBM539070

N#CCC1(CC(C1)C#N)n1ncc(n1)-c1cc(cc2ncccc12)-c1cnc2[nH]ccc2n1 |(24.32,-.18,;23.07,-1.08,;21.82,-1.99,;20.42,-1.36,;19.01,-.74,;19.64,.67,;21.04,.05,;19.09,2.11,;18.53,3.55,;19.79,-2.77,;20.56,-4.1,;19.53,-5.25,;18.12,-4.62,;18.28,-3.09,;16.79,-5.39,;15.46,-4.62,;14.12,-5.39,;14.12,-6.93,;15.46,-7.7,;15.46,-9.24,;16.79,-10.01,;18.12,-9.24,;18.12,-7.7,;16.79,-6.93,;12.79,-4.62,;12.79,-3.08,;11.46,-2.31,;10.12,-3.08,;8.66,-2.6,;7.75,-3.85,;8.66,-5.1,;10.12,-4.62,;11.46,-5.39,)|

BDBM539071

N#CCC1(CC(C1)C#N)n1ncc(n1)-c1cc(cc2ncccc12)-c1cnc2ncccn12 |(-5.47,1.92,;-3.94,1.76,;-2.41,1.6,;-1.79,.19,;-1.16,-1.21,;-2.57,-1.84,;-3.19,-.43,;-3.12,-3.28,;-3.67,-4.72,;-.38,.82,;-.06,2.33,;1.47,2.49,;2.1,1.08,;.96,.05,;3.61,.76,;4.08,-.7,;5.59,-1.02,;6.62,.12,;6.14,1.58,;7.17,2.73,;6.7,4.19,;5.19,4.51,;4.16,3.37,;4.64,1.9,;6.06,-2.49,;5.16,-3.74,;6.06,-4.98,;7.53,-4.51,;8.86,-5.28,;10.2,-4.51,;10.2,-2.97,;8.86,-2.2,;7.53,-2.97,)|

BDBM539073

N#CCC1(CC(C1)C#N)n1ncc(n1)-c1cc(cc2ncccc12)-c1cnn2cccnc12 |(-5.47,1.92,;-3.94,1.76,;-2.41,1.6,;-1.79,.19,;-1.16,-1.21,;-2.57,-1.84,;-3.19,-.43,;-3.12,-3.28,;-3.67,-4.72,;-.38,.82,;-.06,2.33,;1.47,2.49,;2.1,1.08,;.96,.05,;3.61,.76,;4.08,-.7,;5.59,-1.02,;6.62,.12,;6.14,1.58,;7.17,2.73,;6.7,4.19,;5.19,4.51,;4.16,3.37,;4.64,1.9,;6.06,-2.49,;5.16,-3.74,;6.06,-4.98,;7.53,-4.51,;8.86,-5.28,;10.2,-4.51,;10.2,-2.97,;8.86,-2.2,;7.53,-2.97,)|

BDBM539075

N#CCC1(CC(C1)C#N)n1ncc(n1)-c1cc(cc2ncccc12)-c1cnc2cccnn12 |(-5.47,1.92,;-3.94,1.76,;-2.41,1.6,;-1.79,.19,;-1.16,-1.21,;-2.57,-1.84,;-3.19,-.43,;-3.12,-3.28,;-3.67,-4.72,;-.38,.82,;-.06,2.33,;1.47,2.49,;2.1,1.08,;.96,.05,;3.61,.76,;4.08,-.7,;5.59,-1.02,;6.62,.12,;6.14,1.58,;7.17,2.73,;6.7,4.19,;5.19,4.51,;4.16,3.37,;4.64,1.9,;6.06,-2.49,;5.16,-3.74,;6.06,-4.98,;7.53,-4.51,;8.86,-5.28,;10.2,-4.51,;10.2,-2.97,;8.86,-2.2,;7.53,-2.97,)|

BDBM539076

Nc1nccn2c(cnc12)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-3.65,-6.72,;-2.14,-6.4,;-1.11,-7.54,;.39,-7.22,;.87,-5.76,;-.16,-4.61,;,-3.08,;-1.41,-2.45,;-2.44,-3.6,;-1.67,-4.93,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539077

Nc1nc(cn2ccnc12)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-1.33,-6.93,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-4.13,-2.6,;-5.04,-3.85,;-4.13,-5.1,;-2.67,-4.62,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539078

Cc1nc2ccc(nc2[nH]1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(5.02,-5.92,;6.56,-5.92,;7.46,-7.17,;8.92,-6.69,;10.26,-7.46,;11.59,-6.69,;11.59,-5.15,;10.26,-4.38,;8.92,-5.15,;7.46,-4.68,;12.93,-4.38,;12.93,-2.84,;14.26,-2.07,;14.26,-.53,;15.51,.37,;15.03,1.84,;13.49,1.84,;13.01,.37,;12.58,3.08,;13.83,3.99,;13.67,5.52,;13.51,7.05,;11.34,2.18,;10.43,3.42,;11.68,4.33,;8.91,3.66,;7.39,3.91,;15.59,-2.84,;16.93,-2.07,;18.26,-2.84,;18.26,-4.38,;16.93,-5.15,;15.59,-4.38,;14.26,-5.15,)|

BDBM539079

CN1C(=O)COc2ccc(nc12)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(5.33,-4.62,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;6.67,-.77,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;,-3.08,;,-4.62,;-1.33,-5.39,;-1.33,-6.93,;-2.58,-7.84,;-2.1,-9.3,;-.56,-9.3,;-.09,-7.84,;.34,-10.55,;-.9,-11.45,;-.74,-12.98,;-.58,-14.51,;1.59,-9.64,;2.49,-10.89,;1.25,-11.79,;4.01,-11.13,;5.53,-11.37,;-2.67,-4.62,;-4,-5.39,;-5.33,-4.62,;-5.33,-3.08,;-4,-2.31,;-2.67,-3.08,;-1.33,-2.31,)|

BDBM539081

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1cccc(CN)c1

BDBM539083

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1cccc(CO)c1

BDBM539084

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1cccc(c1)C(N)=O

BDBM539085

NC(=O)c1cccc(c1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-2.67,-7.7,;-1.33,-6.93,;,-7.7,;-1.33,-5.39,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.51,5.4,;3.07,6.83,;3.62,8.27,;.4,6.58,;-1.02,5.99,;-.43,4.57,;-2.44,6.58,;-3.87,7.17,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539087

NC(=O)c1ccc(cc1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-5.33,-4.62,;-4,-5.39,;-4,-6.93,;-2.67,-4.62,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.51,5.4,;3.07,6.83,;3.62,8.27,;.4,6.58,;-1.02,5.99,;-.43,4.57,;-2.44,6.58,;-3.87,7.17,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539089

OC(=O)c1ccc(cc1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-5.33,-4.62,;-4,-5.39,;-4,-6.93,;-2.67,-4.62,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;2.51,5.4,;3.07,6.83,;3.62,8.27,;.4,6.58,;-1.02,5.99,;-.43,4.57,;-2.44,6.58,;-3.87,7.17,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539091

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1ccccc1O

BDBM539092

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1cccc(O)c1

BDBM539093

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1ccc(O)cc1

BDBM539094

NCCOc1ccc(cc1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(-5.33,-9.24,;-5.33,-7.7,;-4,-6.93,;-4,-5.39,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,;,-3.08,;,-4.62,;-1.33,-5.39,;1.33,-2.31,;1.33,-.77,;2.67,,;2.67,1.54,;3.91,2.45,;3.44,3.91,;1.9,3.91,;1.42,2.45,;.99,5.16,;-.25,4.25,;-1.66,4.88,;-3.07,5.5,;.09,6.4,;1.33,7.31,;2.24,6.06,;1.57,8.83,;1.81,10.35,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;5.33,-3.08,;4,-2.31,;2.67,-3.08,)|

BDBM539095

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1ccc(F)cc1O

BDBM539097

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1cc(O)cc(F)c1

BDBM539098

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1ccc(O)c(F)c1

BDBM539099

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1cccc(CO)c1F

BDBM539100

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1ccc(F)c(CO)c1

BDBM539101

N#CCC1(CC(C1)C#N)n1ncc(n1)-c1cc(cc2ncccc12)-c1ccc(cc1)-c1nnn[nH]1 |(1.92,9.12,;2.08,7.59,;2.24,6.06,;.99,5.16,;-.25,4.25,;-1.16,5.5,;.09,6.4,;-2.68,5.74,;-4.2,5.98,;1.9,3.91,;3.44,3.91,;3.91,2.45,;2.67,1.54,;1.42,2.45,;2.67,,;1.33,-.77,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;6.67,-.77,;5.33,,;4,-.77,;,-3.08,;,-4.62,;-1.33,-5.39,;-2.67,-4.62,;-2.67,-3.08,;-1.33,-2.31,;-4,-5.39,;-4.16,-6.92,;-5.67,-7.24,;-6.44,-5.91,;-5.41,-4.76,)|

BDBM539102

CS(=O)(=O)N1CC(CC#N)(C1)n1ncc(n1)-c1cc(cc2ncccc12)-c1ccc2CNC(=O)c2c1

BDBM539103

O=C1Cc2cccc(c2N1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)c2cccnc2c1 |(2.62,-5.92,;4.16,-5.92,;5.07,-7.17,;6.53,-6.69,;7.87,-7.46,;9.2,-6.69,;9.2,-5.15,;7.87,-4.38,;6.53,-5.15,;5.07,-4.68,;7.87,-2.84,;6.53,-2.07,;6.53,-.53,;5.2,.24,;5.04,1.77,;3.53,2.09,;2.76,.76,;3.79,-.39,;1.23,.59,;1.07,2.13,;-.34,2.75,;-1.75,3.38,;1.39,-.94,;-.14,-1.1,;-.3,.43,;-1.11,-2.3,;-2.08,-3.49,;7.87,.24,;7.87,1.78,;9.2,2.55,;10.53,1.78,;10.53,.24,;9.2,-.53,;9.2,-2.07,)|

BDBM539105

CS(=O)(=O)N1CC(CC#N)(C1)n1cnc(n1)-c1cc(cc2ncccc12)-c1ccc(=O)[nH]c1

BDBM539106

CS(=O)(=O)N1CC(CC#N)(C1)n1cnc(n1)-c1cc(cc2ncccc12)-c1ccn[nH]1

BDBM539107

CS(=O)(=O)N1CC(CC#N)(C1)n1cnc(n1)-c1cc(cc2ncccc12)-c1cn[nH]c1

BDBM539108

N#CCC1(CC(C1)C#N)n1cc(cn1)-c1cc(cc2nccn12)-c1cc[nH]n1 |(5.37,11.43,;5.53,9.9,;5.69,8.37,;4.45,7.47,;3.2,6.56,;2.29,7.81,;3.54,8.71,;.77,8.05,;-.75,8.29,;5.35,6.22,;4.87,4.76,;6.12,3.85,;7.37,4.76,;6.89,6.22,;6.12,2.31,;7.45,1.54,;7.45,,;6.12,-.77,;4.79,,;3.32,-.48,;2.42,.77,;3.32,2.02,;4.79,1.54,;8.79,-.77,;8.95,-2.3,;10.46,-2.62,;11.23,-1.29,;10.19,-.14,)|

BDBM539110

N#CCC1(CC(C1)C#N)n1cc(cn1)-c1cc(cc2nccn12)-c1cn[nH]c1 |(5.37,11.43,;5.53,9.9,;5.69,8.37,;4.45,7.47,;3.2,6.56,;2.29,7.81,;3.54,8.71,;.77,8.05,;-.75,8.29,;5.35,6.22,;4.87,4.76,;6.12,3.85,;7.37,4.76,;6.89,6.22,;6.12,2.31,;7.45,1.54,;7.45,,;6.12,-.77,;4.79,,;3.32,-.48,;2.42,.77,;3.32,2.02,;4.79,1.54,;8.79,-.77,;10.19,-.14,;11.23,-1.29,;10.46,-2.62,;8.95,-2.3,)|

BDBM50548376

Cn1cc(cn1)-c1cc(-c2cnn(c2)C2(CC#N)CN(CC(F)(F)F)C2)n2ccnc2c1

BDBM539112

Cn1cc(cn1)-c1cc(-c2cnn(c2)C2(CC#N)CC(C2)C#N)n2ccnc2c1 |(11.08,-4.03,;10.46,-2.62,;8.95,-2.3,;8.79,-.77,;10.19,-.14,;11.23,-1.29,;7.45,,;7.45,1.54,;6.12,2.31,;6.12,3.85,;7.37,4.76,;6.89,6.22,;5.35,6.22,;4.87,4.76,;4.45,7.47,;5.69,8.37,;5.53,9.9,;5.37,11.43,;3.2,6.56,;2.29,7.81,;3.54,8.71,;.77,8.05,;-.75,8.29,;4.79,1.54,;3.32,2.02,;2.42,.77,;3.32,-.48,;4.79,,;6.12,-.77,)|

BDBM539114

COC1CC(CC#N)(C1)n1cc(cn1)-c1cc(cc2nccn12)-c1cnn(C)c1 |(2.76,11.84,;4.15,11.17,;4.27,9.64,;5.45,8.64,;4.45,7.47,;3.75,6.09,;2.21,6.01,;.67,5.93,;3.27,8.47,;5.35,6.22,;4.87,4.76,;6.12,3.85,;7.37,4.76,;6.89,6.22,;6.12,2.31,;7.45,1.54,;7.45,,;6.12,-.77,;4.79,,;3.32,-.48,;2.42,.77,;3.32,2.02,;4.79,1.54,;8.79,-.77,;10.19,-.14,;11.23,-1.29,;10.46,-2.62,;11.08,-4.03,;8.95,-2.3,)|

BDBM539115

Cc1cc([nH]n1)-c1cc(-c2cnn(c2)C2(CC#N)CC(C2)C#N)n2ccnc2c1 |(12.76,-1.13,;11.23,-1.29,;10.19,-.14,;8.79,-.77,;8.95,-2.3,;10.46,-2.62,;7.45,,;7.45,1.54,;6.12,2.31,;6.12,3.85,;7.37,4.76,;6.89,6.22,;5.35,6.22,;4.87,4.76,;4.45,7.47,;5.69,8.37,;5.53,9.9,;5.37,11.43,;3.2,6.56,;2.29,7.81,;3.54,8.71,;.77,8.05,;-.75,8.29,;4.79,1.54,;3.32,2.02,;2.42,.77,;3.32,-.48,;4.79,,;6.12,-.77,)|

BDBM539116

Cc1cc(n[nH]1)-c1cc(-c2cnn(c2)C2(CC#N)CC(C2)C#N)n2ccnc2c1 |(11.08,-4.03,;10.46,-2.62,;8.95,-2.3,;8.79,-.77,;10.19,-.14,;11.23,-1.29,;7.45,,;7.45,1.54,;6.12,2.31,;6.12,3.85,;7.37,4.76,;6.89,6.22,;5.35,6.22,;4.87,4.76,;4.45,7.47,;5.69,8.37,;5.53,9.9,;5.37,11.43,;3.2,6.56,;2.29,7.81,;3.54,8.71,;.77,8.05,;-.75,8.29,;4.79,1.54,;3.32,2.02,;2.42,.77,;3.32,-.48,;4.79,,;6.12,-.77,)|

BDBM539117

COC1CC(CC#N)(C1)n1cc(cn1)-c1cc(cc2nccn12)-c1c[nH]nc1CO |(8.43,11.56,;7.88,10.12,;6.36,9.88,;5.11,10.78,;4.21,9.54,;2.96,10.44,;3.12,11.98,;3.28,13.51,;5.45,8.63,;3.3,8.29,;3.78,6.83,;2.53,5.92,;1.28,6.83,;1.76,8.29,;2.53,4.38,;3.86,3.61,;3.86,2.07,;2.53,1.3,;1.2,2.07,;-.27,1.6,;-1.17,2.84,;-.27,4.09,;1.2,3.61,;5.2,1.3,;5.36,-.23,;6.87,-.55,;7.64,.78,;6.6,1.93,;6.92,3.44,;8.39,3.91,)|

BDBM539119

Cc1ncc([nH]1)-c1cc(-c2cnn(c2)C2(CC#N)CC(C2)C#N)n2ccnc2c1 |(11.08,-4.03,;10.46,-2.62,;11.23,-1.29,;10.19,-.14,;8.79,-.77,;8.95,-2.3,;7.45,,;7.45,1.54,;6.12,2.31,;6.12,3.85,;7.37,4.76,;6.89,6.22,;5.35,6.22,;4.87,4.76,;4.45,7.47,;5.69,8.37,;5.53,9.9,;5.37,11.43,;3.2,6.56,;2.29,7.81,;3.54,8.71,;.77,8.05,;-.75,8.29,;4.79,1.54,;3.32,2.02,;2.42,.77,;3.32,-.48,;4.79,,;6.12,-.77,)|

BDBM539120

Nc1n[nH]cc1-c1cc(-c2cnn(c2)C2(CC#N)CC(C2)C#N)n2ccnc2c1 |(6.92,3.44,;6.6,1.93,;7.64,.78,;6.87,-.55,;5.36,-.23,;5.2,1.3,;3.86,2.07,;3.86,3.61,;2.53,4.38,;2.53,5.92,;1.28,6.83,;1.76,8.29,;3.3,8.29,;3.78,6.83,;4.21,9.54,;2.96,10.44,;3.12,11.98,;3.28,13.51,;5.11,10.78,;6.36,9.88,;5.45,8.63,;7.88,10.12,;9.4,10.36,;1.2,3.61,;-.27,4.09,;-1.17,2.84,;-.27,1.6,;1.2,2.07,;2.53,1.3,)|

BDBM539121

OCc1csc(n1)-c1cc(-c2cnn(c2)C2(CC#N)CC(C2)C#N)n2ccnc2c1 |(12.61,-4.19,;11.08,-4.03,;10.46,-2.62,;11.23,-1.29,;10.19,-.14,;8.79,-.77,;8.95,-2.3,;7.45,,;7.45,1.54,;6.12,2.31,;6.12,3.85,;7.37,4.76,;6.89,6.22,;5.35,6.22,;4.87,4.76,;4.45,7.47,;5.69,8.37,;5.53,9.9,;5.37,11.43,;3.2,6.56,;2.29,7.81,;3.54,8.71,;.77,8.05,;-.75,8.29,;4.79,1.54,;3.32,2.02,;2.42,.77,;3.32,-.48,;4.79,,;6.12,-.77,)|

BDBM539122

Oc1ccc(cc1)-c1cc(-c2cnn(c2)C2(CC#N)CC(C2)C#N)n2ccnc2c1 |(12.79,-3.08,;11.46,-2.31,;11.46,-.77,;10.12,,;8.79,-.77,;8.79,-2.31,;10.12,-3.08,;7.45,,;7.45,1.54,;6.12,2.31,;6.12,3.85,;7.37,4.76,;6.89,6.22,;5.35,6.22,;4.87,4.76,;4.45,7.47,;5.69,8.37,;5.53,9.9,;5.37,11.43,;3.2,6.56,;2.29,7.81,;3.54,8.71,;.77,8.05,;-.75,8.29,;4.79,1.54,;3.32,2.02,;2.42,.77,;3.32,-.48,;4.79,,;6.12,-.77,)|

BDBM539123

Nc1ccc(cn1)-c1cc(-c2cnn(c2)C2(CC#N)CC(C2)C#N)n2ccnc2c1 |(9.2,-1.01,;7.87,-.24,;6.53,-1.01,;5.2,-.24,;5.2,1.3,;6.53,2.07,;7.87,1.3,;3.86,2.07,;3.86,3.61,;2.53,4.38,;2.53,5.92,;1.28,6.83,;1.76,8.29,;3.3,8.29,;3.78,6.83,;4.21,9.54,;2.96,10.44,;3.12,11.98,;3.28,13.51,;5.11,10.78,;6.36,9.88,;5.45,8.63,;7.88,10.12,;9.4,10.36,;1.2,3.61,;-.27,4.09,;-1.17,2.84,;-.27,1.6,;1.2,2.07,;2.53,1.3,)|

BDBM539124

NC(=O)c1cccc(n1)-c1cc(-c2cnn(c2)C2(CC#N)CC(C2)C#N)n2ccnc2c1 |(8.79,-5.39,;10.12,-4.62,;11.46,-5.39,;10.12,-3.08,;11.46,-2.31,;11.46,-.77,;10.12,,;8.79,-.77,;8.79,-2.31,;7.45,,;7.45,1.54,;6.12,2.31,;6.12,3.85,;7.37,4.76,;6.89,6.22,;5.35,6.22,;4.87,4.76,;4.45,7.47,;5.97,7.71,;6.52,9.14,;7.07,10.58,;3.86,8.89,;2.43,8.3,;3.02,6.88,;1.01,8.89,;-.41,9.48,;4.79,1.54,;3.32,2.02,;2.42,.77,;3.32,-.48,;4.79,,;6.12,-.77,)|

BDBM539125

COc1nc(ccc1N)-c1cc(-c2cnn(c2)C2(CC#N)CC(C2)C#N)n2ccnc2c1 |(10.53,1.3,;9.2,2.07,;7.87,1.3,;6.53,2.07,;5.2,1.3,;5.2,-.24,;6.53,-1.01,;7.87,-.24,;9.2,-1.01,;3.86,2.07,;3.86,3.61,;2.53,4.38,;2.53,5.92,;1.28,6.83,;1.76,8.29,;3.3,8.29,;3.78,6.83,;4.21,9.54,;2.96,10.44,;3.12,11.98,;3.28,13.51,;5.11,10.78,;6.36,9.88,;5.45,8.63,;7.88,10.12,;9.4,10.36,;1.2,3.61,;-.27,4.09,;-1.17,2.84,;-.27,1.6,;1.2,2.07,;2.53,1.3,)|

BDBM539126

Cn1cc(cn1)-c1cc(-c2ccn(n2)C2(CC#N)CN(CC(F)(F)F)C2)n2ccnc2c1

BDBM539127

Cn1cc(cn1)-c1cc(-c2cnn(n2)C2(CC#N)CC(C2)C#N)n2ccnc2c1 |(11.08,-4.03,;10.46,-2.62,;8.95,-2.3,;8.79,-.77,;10.19,-.14,;11.23,-1.29,;7.45,,;7.45,1.54,;6.12,2.31,;6.12,3.85,;7.37,4.76,;6.89,6.22,;5.35,6.22,;4.87,4.76,;4.45,7.47,;5.69,8.37,;5.53,9.9,;5.37,11.43,;3.2,6.56,;2.29,7.81,;3.54,8.71,;.77,8.05,;-.75,8.29,;4.79,1.54,;3.32,2.02,;2.42,.77,;3.32,-.48,;4.79,,;6.12,-.77,)|

BDBM50548377

Cn1cc(cn1)-c1cc(-c2cnn(c2)C2(CC#N)CN(CC(F)(F)F)C2)n2ncnc2c1

BDBM539130

Cn1cc(cn1)-c1cc(-c2ccn(n2)C2(CC#N)CN(CC(F)(F)F)C2)n2ncnc2c1

BDBM539131

Cn1cc(cn1)-c1cn2ncnc2c(n1)-c1cnn(c1)C1(CC#N)CN(CC#N)C1

BDBM539132

Cn1cc(cn1)-c1cc2nccnc2c(n1)-c1cnn(c1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM539133

Cn1cc(cn1)-c1cc2nccnc2c(n1)-c1cnn(c1)C1(CC#N)CN(CC#N)C1

BDBM539134

Cn1cc(cn1)-c1cc2nccnc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC#N)C1

BDBM539135

Cn1cc(cn1)-c1cc2nccnc2c(n1)-c1ccn(n1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM539139

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CC(NCc2[nH]1)C(=O)N1CCN(C)CC1

BDBM539141

CCN1Cc2[nH]c(nc2C[C@@H]1C(=O)N1CCN(CC1)C(C)(C)C)-c1n[nH]c2cc(ccc12)-c1cc(F)c(O)cc1CC |r|

BDBM539143

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2C[C@H](CN3CC[C@@H](C3)N(C)C)N(Cc2[nH]1)C(C)C |r|

BDBM549192

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCc2[nH]1)C1CN(CCO)C1

BDBM549193

CCN1CC(C1)N1CCc2[nH]c(nc2C1)-c1n[nH]c2cc(ccc12)-c1cc(F)c(O)cc1CC

BDBM549196

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCc2[nH]1)C1CCC(C)C(C1)C(=O)OC

BDBM549197

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCNC3CC(C3)OC)CCc2[nH]1 |(-9.49,-2.64,;-8.13,-1.85,;-8.11,-.27,;-9.44,.46,;-9.44,2.04,;-10.82,2.74,;-8.13,2.77,;-8.11,4.29,;-6.8,2.01,;-6.8,.49,;-5.44,-.3,;-4.14,.43,;-2.78,-.3,;-2.81,-1.82,;-1.61,-2.85,;-2.27,-4.29,;-3.81,-4.13,;-4.09,-2.58,;-5.44,-1.82,;-.09,-2.55,;.81,-1.31,;2.28,-1.78,;3.61,-1.01,;4.94,-1.78,;6.28,-1.01,;7.61,-1.78,;8.94,-1.01,;10.28,-1.78,;10.52,-3.31,;12.04,-3.06,;11.8,-1.54,;13.29,-3.97,;14.73,-3.33,;4.94,-3.32,;3.61,-4.09,;2.28,-3.32,;.81,-3.8,)|

BDBM555303

COc1ccccc1CNc1nc(Cc2cnn(C)c2)ncc1C(N)=O |$;;;;;;;;;;;;;N;;;;;;;;;;;;$|

BDBM555304

COc1cccc(F)c1CNc1nc(Cc2cnn(C)c2)ncc1C(N)=O |$;;;;;;;;;;;;;;N;;;;;;;;;;;;$|

BDBM555305

Cc1cccc(C)c1CNc1nc(Cc2cnn(C)c2)ncc1C(N)=O |$;;;;;;;;;;;;;N;;;;;;;;;;;;$|

BDBM555335

CCn1cc(Nc2ncc(C(N)=O)c(NCCC(C)C)n2)cn1

BDBM555375

CCc1ccccc1CNc1nc(Nc2cnn(CC)c2)ncc1C(N)=O

BDBM555410

CCn1cc(Nc2ncc(C(N)=O)c(NCc3c(F)cccc3Cl)n2)cn1

BDBM555411

CCn1cc(Nc2ncc(C(N)=O)c(NCc3c(F)cccc3C(F)(F)F)n2)cn1

BDBM555461

NC(=O)c1cnc(Nc2cnn(c2)C2CCOCC2)nc1NCc1c(F)cccc1F

BDBM555474

CCn1cc(Nc2ncc(C(N)=O)c(NCc3c(F)cccc3OC)n2)cn1

BDBM555475

COc1cccc(F)c1CNc1nc(Nc2cnn(c2)C(C)C)ncc1C(N)=O

BDBM555476

COc1cccc(F)c1CNc1nc(Nc2cnn(c2)C2CC2)ncc1C(N)=O

BDBM555484

COc1cccc(F)c1CNc1nc(Nc2cnn(CCN(C)C)c2)ncc1C(N)=O

BDBM555505

CC(C)CCNc1nc(Nc2cnn(CC(C)(C)C)c2)ncc1C(N)=O

BDBM555516

CCc1ccccc1Nc1nc(Nc2cnn(c2)C(C)(C)C)ncc1C(N)=O

BDBM555517

CCc1ccccc1Nc1nc(Nc2cnn(c2)C2CCOCC2)ncc1C(N)=O

BDBM555521

COc1ccccc1Nc1nc(Nc2cnn(c2)C(C)(C)C)ncc1C(N)=O

BDBM555522

CC(C)(C)n1cc(Nc2ncc(C(N)=O)c(Nc3c(F)cccc3F)n2)cn1

BDBM555523

CCn1cc(Nc2ncc(C(N)=O)c(Nc3c(F)cccc3Cl)n2)cn1

BDBM555527

CC(C)(C)n1cc(Nc2ncc(C(N)=O)c(Nc3c(F)cccc3Cl)n2)cn1

BDBM555531

NC(=O)c1cnc(Nc2cnn(c2)C2CCOCC2)nc1Nc1c(F)cccc1Cl

BDBM555534

Cc1cccc(F)c1Nc1nc(Nc2cnn(C)c2)ncc1C(N)=O

BDBM555535

CCn1cc(Nc2ncc(C(N)=O)c(Nc3c(C)cccc3F)n2)cn1

BDBM555538

CCc1cccc(F)c1Nc1nc(Nc2cnn(C)c2)ncc1C(N)=O

BDBM555539

CCc1cccc(F)c1Nc1nc(Nc2cnn(CC)c2)ncc1C(N)=O

BDBM555541

COc1cccc(F)c1Nc1nc(Nc2cnn(c2)C(C)(C)C)ncc1C(N)=O

BDBM555542

CCn1cc(Nc2ncc(C(N)=O)c(Nc3c(C)cccc3C)n2)cn1

BDBM555543

CC(C)n1cc(Nc2ncc(C(N)=O)c(Nc3c(C)cccc3C)n2)cn1

BDBM555544

Cc1cccc(C)c1Nc1nc(Nc2cnn(c2)C(C)(C)C)ncc1C(N)=O

BDBM555545

Cc1cccc(C)c1Nc1nc(Nc2cnn(c2)C2CCOCC2)ncc1C(N)=O

BDBM555547

Cn1cc(Nc2ncc(C(N)=O)c(Nc3ccccc3C#C)n2)cn1

BDBM555549

Cn1cc(Nc2ncc(C(N)=O)c(Nc3ccccc3C=C)n2)cn1

BDBM555550

C\C=C\c1ccccc1Nc1nc(Nc2cnn(C)c2)ncc1C(N)=O

BDBM555551

Cn1cc(Nc2ncc(C(N)=O)c(Nc3ccccc3CC=C)n2)cn1

BDBM555552

CC(C)(C)n1cc(Cc2ncc(C(N)=O)c(NCCC=C)n2)cn1 |$;;;;;;;N;;;;;;;;;;;;;;;;$|

BDBM555553

CC(=C)CNc1nc(Nc2cnn(c2)C(C)(C)C)ncc1C(N)=O

BDBM555554

[#6]\[#6](-[#6])=[#6]/[#6]-[#7]-c1nc(-[#7]-c2cnn(c2)C([#6])([#6])[#6])ncc1-[#6](-[#7])=O

BDBM555555

CC(C)(C)n1cc(Nc2ncc(C(N)=O)c(NCCCC=C)n2)cn1

BDBM555560

CC(C)(C)n1cc(Nc2ncc(C(N)=O)c(NCC3CC=CC3)n2)cn1 |c:20|

BDBM555566

CC(=C)CCNc1nc(Nc2cnn(c2)C(C)(C)C)ncc1C(N)=O

BDBM555569

[#6]\[#6](-[#6])=[#6]/[#6]-[#6]-[#6]-[#7]-c1nc(-[#7]-c2cnn(c2)C([#6])([#6])[#6])ncc1-[#6](-[#7])=O

BDBM555570

CC(C)C\C=C\CNc1nc(Nc2cnn(c2)C(C)(C)C)ncc1C(N)=O

BDBM569233

Cc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3ncccn3)cc12 |r|

BDBM569234

Cc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3cccnc3)cc12 |r|

BDBM569235

Cc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3cnccn3)cc12 |r|

BDBM569236

Cc1cncc2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc(cc3)S(=O)(=O)Nc3ccccn3)cc12 |r|

BDBM569237

Clc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3cccnc3)cc12 |r|

BDBM569238

Clc1cncc2ccc(NC(=O)[C@@H]3CC3c3cc(cs3)C(=O)NCc3ncccn3)cc12 |r|

BDBM569239

Clc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3ccccn3)cc12 |r|

BDBM569240

Clc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3ncccn3)cc12 |r|

BDBM569243

Fc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3ccccn3)cc12 |r|

BDBM569244

Fc1ccc(NS(=O)(=O)c2ccc(cc2)C2C[C@H]2C(=O)Nc2ccc3cncc(Cl)c3c2)nc1 |r|

BDBM569248

Cc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3ccccn3)cc12 |r|

BDBM569251

O=C(Nc1ccc2cnccc2c1)[C@@H]1CC1c1ccc(cc1)S(=O)(=O)Nc1ccccn1 |r|

BDBM569252

O=C(Nc1ccc2cnccc2c1)[C@@H]1CC1c1ccc(cc1)S(=O)(=O)Nc1cccnc1 |r|

BDBM569325

Clc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)NC[C@@H]3CCCNC3)cc12 |r|

BDBM569256

Fc1cnc(NS(=O)(=O)c2ccc(cc2)C2C[C@H]2C(=O)Nc2ccc3cncc(C#N)c3c2)nc1 |r|

BDBM569264

Clc1cncc2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc(cc3)S(=O)(=O)Nc3ncc(cn3)C3CCNCC3)cc12 |r|

BDBM569268

CCc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3ncccn3)cc12 |r|

BDBM569281

Cc1cncc2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc(cc3)S(=O)(=O)Nc3nccs3)cc12 |r|

BDBM569282

Cc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3cccnn3)cc12 |r|

BDBM569295

CCCCc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3ccccn3)cc12 |r|

BDBM569296

NCc1ccnc(NS(=O)(=O)c2ccc(cc2)C2CC2C(=O)Nc2ccc3cncc(Cl)c3c2)c1

BDBM569298

O=C(Nc1ccc2cncc(C3CC3)c2c1)[C@@H]1C[C@H]1c1ccc(cc1)S(=O)(=O)Nc1ccccn1 |r|

BDBM569299

Fc1ccc(NS(=O)(=O)c2ccc(cc2)[C@@H]2C[C@H]2C(=O)Nc2cc3c(Cl)cncc3s2)nc1 |r|

BDBM569301

FC(F)(F)c1cncc2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc(cc3)S(=O)(=O)Nc3nccs3)cc12 |r|

BDBM569304

CCCc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3ccccn3)cc12 |r|

BDBM569305

FC1(F)CNCCC1NS(=O)(=O)c1ccc(cc1)[C@@H]1C[C@H]1C(=O)Nc1ccc2cncc(Cl)c2c1 |r|

BDBM569306

Clc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)NCC3CCCCN3)cc12 |r|

BDBM569308

Cc1nccc2cc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3ccccn3)ccc12 |r|

BDBM569309

CCCc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)NC[C@@H]3CCCNC3)cc12 |r|

BDBM569311

O=C(Nc1ccc2cncc(CC#N)c2c1)[C@@H]1CC1c1ccc(cc1)S(=O)(=O)Nc1ncccn1 |r|

BDBM569312

FC(F)(F)Cc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3ncccn3)cc12 |r|

BDBM569313

FC(F)(F)Oc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3ccccn3)cc12 |r|

BDBM569315

CCCc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3ncccn3)cc12 |r|

BDBM569316

CCc1cncc2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc(cc3)S(=O)(=O)Nc3ncc(cn3)C3CCNCC3)cc12 |r|

BDBM569317

COc1nccc2cc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3ccccn3)ccc12 |r|

BDBM569318

FC(F)(F)Cc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3ccccn3)cc12 |r|

BDBM569345

FC(F)(F)c1cncc2ccc(NC(=O)[C@@H]3C[C@H]3c3cccc(c3)C(=O)NCc3ncccn3)cc12 |r|

BDBM569319

FC(F)(F)c1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)NC[C@@H]3CCCNC3)cc12 |r|

BDBM569320

O=C(Nc1ccc2cncc(C#N)c2c1)[C@@H]1CC1c1ccc(cc1)S(=O)(=O)NC[C@@H]1CCCNC1 |r|

BDBM569265

Cc1cncc2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc(cc3)S(=O)(=O)Nc3cncc(n3)C3CCNCC3)cc12 |r|

BDBM569326

Cc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)NC[C@@H]3CCCNC3)cc12 |r|

BDBM569284

O=C(Nc1ccc2cnccc2c1)[C@@H]1CC1c1ccc(cc1)S(=O)(=O)Nc1cccnn1 |r|

BDBM569271

NC(=N)NS(=O)(=O)c1ccc(cc1)C1C[C@H]1C(=O)Nc1ccc2cnccc2c1 |r|

BDBM569331

CCc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3ccccn3)cc12 |r|

BDBM569253

Cc1cncc2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc(cc3)S(=O)(=O)Nc3cncc(n3)C3=CCNCC3)cc12 |r,t:34|

BDBM569263

Cc1cncc2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc(cc3)S(=O)(=O)Nc3ncc(cn3)C3CCNCC3)cc12 |r|

BDBM569335

FC(F)(F)c1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3ncccn3)cc12 |r|

BDBM569285

Fc1cc(ccc1S(=O)(=O)Nc1ccccn1)C1C[C@H]1C(=O)Nc1ccc2cnccc2c1 |r|

BDBM569288

O=C(Nc1ccc2cncc(C#N)c2c1)[C@@H]1CC1c1ccc(cc1)S(=O)(=O)Nc1ccccn1 |r|

BDBM569338

Cc1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3ccc(F)cn3)cc12 |r|

BDBM569257

Cc1cncc2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc(cc3)S(=O)(=O)NC3CCNC3)cc12 |r|

BDBM569266

Cc1cncc2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc(cc3)S(=O)(=O)NC3CCCNC3)cc12 |r|

BDBM569273

FC(F)(F)c1cncc2ccc(NC(=O)[C@@H]3CC3c3ccc(cc3)S(=O)(=O)Nc3ccccn3)cc12 |r|

BDBM570060

FC1(F)CC1C(=O)NC1CCC(=CC1)c1cccc2nc(NC(=O)C3CC3)nn12 |c:12|

BDBM570061

CC1(CC1(F)F)C(=O)NC1CCC(=CC1)c1cccc2nc(NC(=O)C3CC3)nn12 |c:13|

BDBM570062

FC1CC1C(=O)N[C@@H]1CCC(=CC1)c1cccc2nc(NC(=O)C3CC3)nn12 |r,c:11|

BDBM570063

FC1CC1C(=O)N[C@H]1CCC(=CC1)c1cccc2nc(NC(=O)C3CC3)nn12 |r,c:11|

BDBM570064

O=C(Nc1nc2cccc(C3=CCC(CC3)NC(=O)C3(CC3)C#N)n2n1)C1CC1 |t:10|

BDBM570065

O=C(NC1CCC(=CC1)c1cccc2nc(NC(=O)C3CC3)nn12)C1CC1 |c:6|

BDBM570066

FC1(F)C[C@H]1C(=O)N[C@H]1CCC(=CC1)c1cccc2nc(NC(=O)C3CC3)nn12 |r,c:12|

BDBM570067

FC1(F)C[C@@H]1C(=O)N[C@H]1CCC(=CC1)c1cccc2nc(NC(=O)C3CC3)nn12 |r,c:12|

BDBM570068

FC1(F)C[C@H]1C(=O)N[C@@H]1CCC(=CC1)c1cccc2nc(NC(=O)C3CC3)nn12 |r,c:12|

BDBM570069

FC1(F)C[C@@H]1C(=O)N[C@@H]1CCC(=CC1)c1cccc2nc(NC(=O)C3CC3)nn12 |r,c:12|

BDBM570070

FC1(F)CC1C(=O)NC1CCC(CC1)c1cccc2nc(NC(=O)C3CC3)nn12 |(7.3,7.21,;5.77,7.09,;6.26,5.63,;4.36,6.17,;4.36,7.71,;3.12,8.62,;3.28,10.15,;1.71,7.99,;1.71,6.45,;3.04,5.68,;3.04,4.14,;1.71,3.37,;.37,4.14,;.37,5.68,;1.71,1.83,;3.04,1.06,;3.04,-.48,;1.71,-1.25,;.37,-.48,;-1.09,-.95,;-2,.29,;-3.54,.29,;-4.31,-1.04,;-3.54,-2.38,;-5.85,-1.04,;-6.99,-.01,;-7.25,-1.67,;-1.09,1.54,;.37,1.06,)|

BDBM570071

FC1(CC1)C(=O)NC1CCC(CC1)c1cccc2nc(NC(=O)C3CC3)nn12 |(5.13,9.05,;4.36,7.71,;4.36,6.17,;5.77,7.09,;3.12,8.62,;3.28,10.15,;1.71,7.99,;1.71,6.45,;3.04,5.68,;3.04,4.14,;1.71,3.37,;.37,4.14,;.37,5.68,;1.71,1.83,;3.04,1.06,;3.04,-.48,;1.71,-1.25,;.37,-.48,;-1.09,-.95,;-2,.29,;-3.54,.29,;-4.31,-1.04,;-3.54,-2.38,;-5.85,-1.04,;-6.99,-.01,;-7.25,-1.67,;-1.09,1.54,;.37,1.06,)|

BDBM570072

FC1(CC1)C(=O)NC1CCC(=CC1)c1cccc2nc(NC(=O)C3CC3)nn12 |c:11|

BDBM570074

FC1(F)CC1C(=O)N1CC=C(C1)c1cccc2nc(NC(=O)C3CC3)nn12 |c:10|

BDBM570075

FC1(CC1)C(=O)N1CC=C(C1)c1cccc2nc(NC(=O)C3CC3)nn12 |c:9|

BDBM570076

FC1CC1(F)C(=O)N1CC=C(C1)c1cccc2nc(NC(=O)C3CC3)nn12 |c:10|

BDBM570077

FC1(F)C[C@H]1C(=O)N[C@H]1CCC(CC1)c1cccc2nc(NC(=O)C3CC3)nn12 |r,wU:4.5,8.8,(7.32,7.49,;5.78,7.37,;6.28,5.91,;4.38,6.45,;4.38,7.99,;3.04,8.76,;3.04,10.3,;1.71,7.99,;1.71,6.45,;3.04,5.68,;3.04,4.14,;1.71,3.37,;.37,4.14,;.37,5.68,;1.71,1.83,;3.04,1.06,;3.04,-.48,;1.71,-1.25,;.37,-.48,;-1.09,-.95,;-2,.29,;-3.54,.29,;-4.31,-1.04,;-3.54,-2.38,;-5.85,-1.04,;-6.99,-.01,;-7.25,-1.67,;-1.09,1.54,;.37,1.06,)|

BDBM570078

FC1(F)C[C@@H]1C(=O)N[C@H]1CCC(CC1)c1cccc2nc(NC(=O)C3CC3)nn12 |r,wU:8.8,wD:4.5,(7.32,7.49,;5.78,7.37,;6.28,5.91,;4.38,6.45,;4.38,7.99,;3.04,8.76,;3.04,10.3,;1.71,7.99,;1.71,6.45,;3.04,5.68,;3.04,4.14,;1.71,3.37,;.37,4.14,;.37,5.68,;1.71,1.83,;3.04,1.06,;3.04,-.48,;1.71,-1.25,;.37,-.48,;-1.09,-.95,;-2,.29,;-3.54,.29,;-4.31,-1.04,;-3.54,-2.38,;-5.85,-1.04,;-6.99,-.01,;-7.25,-1.67,;-1.09,1.54,;.37,1.06,)|

BDBM570079

FC1(F)C[C@H]1C(=O)N[C@H]1CCC(CC1)c1cccc2nc(NC(=O)C3CC3)nn12 |r,wU:4.5,wD:8.8,(7.32,7.49,;5.78,7.37,;6.28,5.91,;4.38,6.45,;4.38,7.99,;3.04,8.76,;3.04,10.3,;1.71,7.99,;1.71,6.45,;.37,5.68,;.37,4.14,;1.71,3.37,;3.04,4.14,;3.04,5.68,;1.71,1.83,;3.04,1.06,;3.04,-.48,;1.71,-1.25,;.37,-.48,;-1.09,-.95,;-2,.29,;-3.54,.29,;-4.31,-1.04,;-3.54,-2.38,;-5.85,-1.04,;-6.99,-.01,;-7.25,-1.67,;-1.09,1.54,;.37,1.06,)|

BDBM570080

FC1(F)C[C@@H]1C(=O)N[C@H]1CCC(CC1)c1cccc2nc(NC(=O)C3CC3)nn12 |r,wD:4.5,8.8,(7.32,7.49,;5.78,7.37,;6.28,5.91,;4.38,6.45,;4.38,7.99,;3.04,8.76,;3.04,10.3,;1.71,7.99,;1.71,6.45,;.37,5.68,;.37,4.14,;1.71,3.37,;3.04,4.14,;3.04,5.68,;1.71,1.83,;3.04,1.06,;3.04,-.48,;1.71,-1.25,;.37,-.48,;-1.09,-.95,;-2,.29,;-3.54,.29,;-4.31,-1.04,;-3.54,-2.38,;-5.85,-1.04,;-6.99,-.01,;-7.25,-1.67,;-1.09,1.54,;.37,1.06,)|

BDBM570081

FC1(CC1)C(=O)NC1CCC(CC1)c1cccc2nc(NC(=O)C3CC3)nn12 |(5.07,9.36,;4.38,7.99,;4.38,6.45,;5.78,7.37,;3.04,8.76,;3.04,10.3,;1.71,7.99,;1.71,6.45,;3.04,5.68,;3.04,4.14,;1.71,3.37,;.37,4.14,;.37,5.68,;1.71,1.83,;3.04,1.06,;3.04,-.48,;1.71,-1.25,;.37,-.48,;-1.09,-.95,;-2,.29,;-3.54,.29,;-4.31,-1.04,;-3.54,-2.38,;-5.85,-1.04,;-6.99,-.01,;-7.25,-1.67,;-1.09,1.54,;.37,1.06,)|

BDBM570082

FC1(F)CC1C(=O)N[C@H]1CCC(CC1)C1=CC=CC2=NC(NC(=O)C3CC3)SC12 |r,wD:8.8,c:18,t:16,20,(7.32,7.49,;5.78,7.37,;6.28,5.91,;4.38,6.45,;4.38,7.99,;3.04,8.76,;3.04,10.3,;1.71,7.99,;1.71,6.45,;.37,5.68,;.37,4.14,;1.71,3.37,;3.04,4.14,;3.04,5.68,;1.71,1.83,;3.04,1.06,;3.04,-.48,;1.71,-1.25,;.37,-.48,;-1.09,-.95,;-2,.29,;-3.54,.29,;-4.31,-1.04,;-3.54,-2.38,;-5.85,-1.04,;-6.99,-.01,;-7.25,-1.67,;-1.09,1.54,;.37,1.06,)|

BDBM570420

Fc1cccc(C#N)c1-c1cc(c2C(=O)NCc2n1)-n1ccc(n1)N1CCC(CC1)N1CCOCC1

BDBM570461

OCC1COCCN1c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM570491

CN(C)[C@H]1CC[C@@H](CC1)Oc1ccn(n1)-c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r,wU:3.2,wD:6.9,(-7.23,-2.68,;-8,-1.34,;-9.54,-1.34,;-7.23,-.01,;-8,1.32,;-7.23,2.66,;-5.69,2.66,;-4.92,1.32,;-5.69,-.01,;-4.92,3.99,;-3.38,3.99,;-2.47,5.24,;-1.01,4.76,;-1.02,3.23,;-2.47,2.75,;.52,3.23,;1.42,4.47,;2.89,4,;2.87,2.46,;1.42,1.98,;4.2,1.69,;4.2,.15,;5.54,-.62,;6.87,.15,;6.87,1.69,;8.02,2.72,;7.39,4.13,;5.86,3.97,;4.77,5.06,;5.54,2.46,;5.54,-2.16,;4.2,-2.93,;2.87,-2.16,;4.2,-4.47,;5.54,-5.24,;6.87,-4.47,;6.92,-2.9,;8.25,-2.13,;9.59,-1.36,)|

BDBM570607

CC1(C)CCN(C1)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N

BDBM570620

C[C@]1(O)CN(CCC1O)c1ccn(n1)-c1cc(nc2CNC(=O)c12)-c1c(F)cccc1C#N |r|

BDBM570464

CCS(=O)(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)N(C)c1nc(Nc2cc(C)[nH]n2)cc(n1)C1CCCO1 |r,TLB:2:5:9.8.7:12.11.13|

BDBM570465

CCS(=O)(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)N(C)c1nc(Nc2cc(C)[nH]n2)cc(n1)[C@H]1CCCO1 |r,TLB:2:5:9.8.7:12.11.13|

BDBM570466

CCS(=O)(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)N(C)c1nc(Nc2cc(C)[nH]n2)cc(n1)[C@@H]1CCCO1 |r,TLB:2:5:9.8.7:12.11.13|

BDBM570467

COC(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)N(C)c1nc(Nc2cc(C)[nH]n2)cc(n1)C1CCCO1 |r,TLB:2:4:8.7.6:11.10.12|

BDBM570469

COCCOC(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)N(C)c1nc(Nc2cc(C)[nH]n2)cc(n1)C1CCCO1 |r,TLB:5:7:11.10.9:14.13.15|

BDBM570471

CN([C@H]1C[C@@H]2CCC[C@H](C1)N2C(=O)OC1CCOCC1)c1nc(Cl)cc(Nc2cc(C)[nH]n2)n1 |r,TLB:11:10:7.6.5:2.9.3|

BDBM570479

CN([C@H]1C[C@@H]2CCC[C@H](C1)N2C(=O)OC1CCOCC1)c1nc(Nc2cc(C)[nH]n2)cc(O[C@@H]2CCOC2)n1 |r,TLB:11:10:7.6.5:2.9.3|

BDBM570480

COCCOC(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)N(C)c1nc(Nc2cc(C)[nH]n2)cc(O[C@@H]2CCOC2)n1 |r,TLB:5:7:11.10.9:14.13.15|

BDBM570481

COC(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)N(C)c1nc(Nc2cc(C)[nH]n2)cc(O[C@@H]2CCOC2)n1 |r,TLB:2:4:8.7.6:11.10.12|

BDBM570483

COCCC(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)N(C)c1nc(Nc2cc(C)[nH]n2)cc(O[C@@H]2CCOC2)n1 |r,TLB:4:6:10.9.8:13.12.14|

BDBM570489

CN([C@H]1C[C@@H]2CCC[C@H](C1)N2CC(=O)N1CCCC1)c1nc(Nc2cc(C)[nH]n2)cc(O[C@H]2CCOC2)n1 |r,TLB:11:10:7.6.5:2.9.3|

BDBM570490

CCNC(=O)CN1[C@H]2CCC[C@@H]1C[C@H](C2)N(C)c1nc(Nc2cc(C)[nH]n2)cc(O[C@H]2CCOC2)n1 |r,TLB:5:6:10.9.8:13.12.14|

BDBM570497

CN([C@H]1C[C@@H]2CCC[C@H](C1)N2C(=O)CC1CC1)c1nc(Nc2cc(C)[nH]n2)cc(OC2COC2)n1 |r,TLB:11:10:7.6.5:2.9.3|

BDBM570509

CCS(=O)(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)N(C)c1nc(COS(C)(=O)=O)c(F)c(Nc2cc(C)[nH]n2)n1 |r,TLB:2:5:9.8.7:12.11.13|

BDBM570510

CCS(=O)(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)N(C)c1nc(CO[C@H]2CCOC2)c(F)c(Nc2cc(C)[nH]n2)n1 |r,TLB:2:5:9.8.7:12.11.13|

BDBM570511

CCS(=O)(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)N(C)c1nc(CO[C@@H]2CCOC2)c(F)c(Nc2cc(C)[nH]n2)n1 |r,TLB:2:5:9.8.7:12.11.13|

BDBM573151

CCN1Cc2[nH]c(nc2C[C@@H]1C(=O)N1CC(C1)N1CCCC1)-c1n[nH]c2cc(ccc12)-c1cc(F)c(O)cc1CC |r|

BDBM575199

CC[C@H](Cn1ccc2cnc(Nc3cnn(CC(=O)O[C@@H]4C[C@H](N(C)C4)C(=O)OC)c3)nc12)C(C)C |r|

BDBM575200

CCC(CC)Cn1ccc2cnc(Nc3cnn(CC(=O)O[C@@H]4C[C@H](N(C)C4)C(=O)OC)c3)nc12 |r|

BDBM575201

CCOC(=O)[C@@H]1C[C@H](CN1C)OC(=O)Cn1cc(Nc2ncc3ccn(C[C@@H](CC)C(C)C)c3n2)cn1 |r|

BDBM575202

CC[C@H](Cn1ccc2cnc(Nc3cnn(CC(=O)O[C@@H]4C[C@H](N(C)C4)C(=O)OC(C)C)c3)nc12)C(C)C |r|

BDBM575203

CC[C@H](Cn1ccc2cnc(Nc3cnn(CC(=O)O[C@@H]4C[C@H](N(C)C4)C(O)=O)c3)nc12)C(C)C |r|

BDBM577199

CNC(=O)c1cc(n[nH]1)-c1cn2nccc2c(n1)-c1cnn(c1)[C@@]1(CC#N)C[C@@H](C1)OC |r,wU:23.26,wD:28.34,(7.76,-5.97,;6.23,-6.13,;5.32,-4.88,;5.95,-3.48,;3.79,-5.04,;2.76,-3.9,;1.35,-4.53,;1.51,-6.06,;3.02,-6.38,;.02,-3.76,;-1.31,-4.53,;-2.65,-3.76,;-4.11,-4.23,;-5.02,-2.99,;-4.11,-1.74,;-2.65,-2.22,;-1.31,-1.45,;.02,-2.22,;-1.31,.09,;-.07,1,;-.54,2.46,;-2.08,2.46,;-2.56,1,;-2.99,3.71,;-1.45,3.71,;-.68,5.04,;.09,6.38,;-4.32,2.94,;-5.09,4.27,;-3.76,5.04,;-6.43,5.04,;-7.76,4.27,)|

BDBM500288

CNC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM593006

CNC(=O)c1nnc(NC(=O)[C@@H]2CC2(F)F)cc1Nc1cccc(-c2ncn(C)n2)c1OC |r|

BDBM593021

CNC(=O)c1nnc(NC(=O)[C@H]2CC2(F)F)cc1Nc1cccc(-c2ncn(C)n2)c1OC |r|

BDBM603958

CCCn1cc(Nc2nccc(n2)N2CC3CCC(C2)N3C(=O)[C@@H]2CC2(F)F)cn1

BDBM603959

C[C@@H](O)Cn1cc(Nc2nccc(n2)N2CC3CCC(C2)N3C(=O)[C@@H]2CC2(F)F)cn1

BDBM603960

C[C@H](O)Cn1cc(Nc2nccc(n2)N2CC3CCC(C2)N3C(=O)[C@@H]2CC2(F)F)cn1

BDBM603961

OCCCn1cc(Nc2nccc(n2)N2CC3CCC(C2)N3C(=O)[C@@H]2CC2(F)F)cn1

BDBM604898

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2C[C@H](NCc2[nH]1)C(=O)N1CCN(CC1)C(C)C |r|

BDBM604911

CCCN1Cc2[nH]c(nc2C[C@@H]1C(=O)N1CC[C@@H](C1)N(C)C)-c1n[nH]c2cc(ccc12)-c1cc(F)c(O)cc1CC |r|

BDBM605447

NC(=O)c1nc(oc1Nc1ccc(cc1)C(=O)NC1CCNC1)-c1c(F)cccc1F

BDBM608405

CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM250092

CN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(Cl)c(Cl)c2)cc1

BDBM608407

CSCCC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM250094

CN1CCN(CC1)c1ccc(NC(=O)Nc2ccc(cc2)-c2cnco2)cc1

BDBM608409

CN(C)C(=O)N1CCN(Cc2cccc(Nc3ncc4ccc(=O)n(CCC5CN(C5)C(=O)C=C)c4n3)c2)CC1

BDBM250096

O=C(Nc1ccccc1)Nc1ccc(cc1)C1CCNC1

BDBM250097

Clc1ccc(NC(=O)Nc2ccc(cc2)C2CCNC2)c(Cl)c1

BDBM608412

CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cn1

BDBM250099

O=C(NCc1ccccc1)Nc1ccc(cc1)C1CCNC1

BDBM608414

C[C@@H]1CN(CCN1c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1)C(C)=O |r|

BDBM608415

CN(C)C\C=C\C(=O)N1CC(CCn2c3cc(Nc4ccc(N)cn4)ncc3ccc2=O)C1

BDBM608416

CC[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(C)c3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608417

CC(C)(C)OC(=O)N1CC(CCn2c3nc(Nc4ccc(N)cc4)ncc3ccc2=O)C1

BDBM608418

CN1CCN(CC1)c1ccc(Nc2cc3n(CCC4CN(C4)C(=O)C=C)c(=O)ccc3cn2)nc1

BDBM608419

Cn1cc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cn1

BDBM608421

Cn1cc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cn1

BDBM608422

CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1Cl

BDBM608423

C=CC(=O)N1CC(CCn2c3nc(Nc4ccccc4)ncc3ccc2=O)C1

BDBM608425

COc1cccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)c1

BDBM608429

Fc1cc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)ccc1N1CCOCC1

BDBM608431

CC(C)OCCn1cc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cn1

BDBM608432

FC(F)OCCn1cc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cn1

BDBM608433

C=CC(=O)N1CC(CCn2c3nc(Nc4ccc(cc4)N4CCSCC4)ncc3ccc2=O)C1

BDBM608434

C=CC(=O)N1CC(CCn2c3nc(Nc4cccc(CN5CCOCC5)c4)ncc3ccc2=O)C1

BDBM608438

C[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(C)c3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608440

CN1CCN(CC1)c1cccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)c1

BDBM608441

Cn1cc(Nc2ncc3ccc(=O)n(CCN4CCN(C(=O)C=C)C5(CC5)C4)c3n2)cn1

BDBM608442

Cn1cc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4(C)C)C(=O)C=C)c3n2)cn1

BDBM608443

C=CC(=O)N1CC(CCn2c3nc(Nc4cnn(c4)-c4ccccc4)ncc3ccc2=O)C1

BDBM608446

CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cn1

BDBM608447

C=CC(=O)N1CCN(CCn2c3nc(Nc4ccc(cc4)N4CCSCC4)ncc3ccc2=O)CC1

BDBM608448

CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1F

BDBM608454

C=CC(=O)N1CC(CCn2c3nc(Nc4ccc(CN5CCOCC5)cc4)ncc3ccc2=O)C1

BDBM608455

CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608456

CN1CCN(Cc2ccc(Nc3ncc4ccc(=O)n(CCC5CN(C5)C(=O)C=C)c4n3)cc2)CC1

BDBM608458

CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1F

BDBM608460

CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1C

BDBM608462

CN1CCC(CC1)n1cc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cn1

BDBM608463

CN1CCN(Cc2cccc(Nc3ncc4ccc(=O)n(CCC5CN(C5)C(=O)C=C)c4n3)c2)CC1

BDBM608464

Fc1cc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)ccc1N1CCSCC1

BDBM608466

CCN(CC)CCn1cc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cn1

BDBM608468

CCOCCn1cc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cn1

BDBM608470

CC(C)(O)Cn1cc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cn1

BDBM608471

COCC(C)(C)n1cc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cn1

BDBM608472

C=CC(=O)N1CC(CCn2c3nc(Nc4ccc5[nH]c(=O)oc5c4)ncc3ccc2=O)C1

BDBM608473

Cn1c2ccc(Nc3ncc4ccc(=O)n(CCC5CN(C5)C(=O)C=C)c4n3)cc2oc1=O

BDBM608474

C=CC(=O)N1CC(CCn2c3nc(Nc4cnn(CCN5CCOCC5)c4)ncc3ccc2=O)C1

BDBM608475

CC(C)(C)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608476

FCCn1cc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cn1

BDBM608477

C=CC(=O)N1CC(CCn2c3nc(Nc4cccc(c4)C(=O)N4CCCCC4)ncc3ccc2=O)C1

BDBM608478

C=CC(=O)N1CC(CCn2c3nc(Nc4cccc(c4)C(=O)N4CCOCC4)ncc3ccc2=O)C1

BDBM608481

C=CC(=O)N1CC(CCn2c3nc(Nc4ccc(cc4)-n4cccn4)ncc3ccc2=O)C1

BDBM608482

C=CC(=O)N1CC(CCn2c3nc(Nc4ccc(cc4)-n4ccnn4)ncc3ccc2=O)C1

BDBM608484

C=CC(=O)N1CC(CCn2c3nc(Nc4cccc(c4)N4CCCCC4)ncc3ccc2=O)C1

BDBM608485

CS(=O)(=O)Nc1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608486

COCC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608487

COC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608488

C=CC(=O)N1CC(CCn2c3nc(Nc4ccc(cc4)N4CCN(CC4)C(=O)CC#N)ncc3ccc2=O)C1

BDBM608489

C=CC(=O)N1CC(CCn2c3nc(Nc4ccc(cc4)-n4ccnc4)ncc3ccc2=O)C1

BDBM608490

CN1CCC(=CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1 |c:4|

BDBM608491

CC(C)C(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608492

COCCS(=O)(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608496

CC(=O)N1CCN(CC1)c1cccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)c1

BDBM608497

CC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM608498

C=CC(=O)N1CCN(CCn2c3nc(Nc4ccc(CN5CCOCC5)cc4)ncc3ccc2=O)CC1

BDBM608500

C=CC(=O)N1CC(CCn2c3nc(Nc4ccc5[nH]ncc5c4)ncc3ccc2=O)C1

BDBM608501

C=CC(=O)N1CC(CCn2c3nc(Nc4ccc5cn[nH]c5c4)ncc3ccc2=O)C1

BDBM608502

C=CC(=O)N1CC(CCn2c3nc(Nc4ccc5[nH]cnc5c4)ncc3ccc2=O)C1

BDBM608503

C=CC(=O)N1CC(CCn2c3nc(Nc4cccc(CN5CCSCC5)c4)ncc3ccc2=O)C1

BDBM608504

C=CC(=O)N1CC(CCn2c3nc(Nc4ccc(CN5CCSCC5)cc4)ncc3ccc2=O)C1

BDBM608505

CN1CCC(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM608506

CCN(CC)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608507

CN(C)CCc1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608508

CN(C)Cc1cccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)c1

BDBM608509

CN(C)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608510

CN(C)C(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608511

CNC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608525

CS(=O)(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608526

CN(C)C(=S)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608527

CNS(=O)(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608528

CN(C)S(=O)(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608529

CC(C)(C)SC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608530

COCCOC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608531

CC(C)OC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608532

C=CC(=O)N1CC(CCn2c3nc(Nc4ccc(cc4)N4CCN(CC4)S(=O)(=O)CC#N)ncc3ccc2=O)C1

BDBM608533

C=CC(=O)N1CC(CCn2c3nc(Nc4ccc(cc4)N4CCN(CC4)S(=O)(=O)C4COC4)ncc3ccc2=O)C1

BDBM608534

CC(C)CC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608535

CC(C)(C)C(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608536

C[C@@H](O)C(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1 |r|

BDBM608537

C[C@H](O)C(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1 |r|

BDBM608538

CSCC(=O)N1CCN(CC1)c1cccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)c1

BDBM608539

COCC(=O)N1CCN(CC1)c1cccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)c1

BDBM608540

FC(F)(F)C(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608541

CSCCC(=O)N1CCN(Cc2cccc(Nc3ncc4ccc(=O)n(CCC5CN(C5)C(=O)C=C)c4n3)c2)CC1

BDBM608542

COC(=O)N1CCN(Cc2cccc(Nc3ncc4ccc(=O)n(CCC5CN(C5)C(=O)C=C)c4n3)c2)CC1

BDBM608543

COCC(=O)N1CCN(Cc2cccc(Nc3ncc4ccc(=O)n(CCC5CN(C5)C(=O)C=C)c4n3)c2)CC1

BDBM608544

C=CC(=O)N1CC(CCn2c3nc(Nc4ccc(cc4)N4CCN(CCN5CCCCC5)CC4)ncc3ccc2=O)C1

BDBM608545

CCN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608546

CCC(C)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608547

C=CC(=O)N1CC(CCn2c3nc(Nc4ccc(cc4)N4CCN(CCC5CCCCC5)CC4)ncc3ccc2=O)C1

BDBM608548

CCOCCN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608549

C=CC(=O)N1CC(CCn2c3nc(Nc4ccc(cc4)N4CCN(CC4)C4CC4)ncc3ccc2=O)C1

BDBM608550

FC(F)(F)CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608551

CC(C)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608552

C[C@H]1CN([C@@H](C)CN1CCn1c2nc(Nc3cnn(C)c3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608553

COCCS(=O)(=O)N1CCN(CC1)c1cccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)c1

BDBM608554

COC(=O)N1CCN(CC1)c1cccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)c1

BDBM608555

CN(C)C(=O)N1CCN(CC1)c1cccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)c1

BDBM608556

C=CC(=O)N1CC(CCn2c3nc(Nc4cccc(CN5CCN(CC5)S(=O)(=O)CC#N)c4)ncc3ccc2=O)C1

BDBM608557

C=CC(=O)N1CC(CCn2c3nc(Nc4cccc(CN5CCN(CC5)S(=O)(=O)C5COC5)c4)ncc3ccc2=O)C1

BDBM608558

CS(=O)(=O)N1CCN(CC1)c1cccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)c1

BDBM608559

C=CC(=O)N1CC(CCn2c3nc(Nc4cccc(c4)N4CCN(CC4)S(=O)(=O)CC#N)ncc3ccc2=O)C1

BDBM608560

C=CC(=O)N1CC(CCn2c3nc(Nc4cccc(c4)N4CCN(CC4)S(=O)(=O)C4COC4)ncc3ccc2=O)C1

BDBM608561

CS(=O)(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM608562

Cn1cc(Nc2ncc3ccc(=O)n(CCN4CCN(C[C@@H]4CO)C(=O)C=C)c3n2)cn1 |r|

BDBM608563

COCCS(=O)(=O)N1CCN(Cc2cccc(Nc3ncc4ccc(=O)n(CCC5CN(C5)C(=O)C=C)c4n3)c2)CC1

BDBM608564

CC(=O)N1CCN(Cc2cccc(Nc3ncc4ccc(=O)n(CCC5CN(C5)C(=O)C=C)c4n3)c2)CC1

BDBM608565

CSCC(=O)N1CCN(Cc2cccc(Nc3ncc4ccc(=O)n(CCC5CN(C5)C(=O)C=C)c4n3)c2)CC1

BDBM608566

COc1cc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)ccc1N1CCN(C)CC1

BDBM608567

CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1O

BDBM608568

CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)nc1

BDBM608569

CC(C)(O)C(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608570

CS(=O)CCC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608571

CS(=O)(=O)CCC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608572

CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)c(F)c1

BDBM608573

CC1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608574

C=CC(=O)N1CC(CCn2c3nc(Nc4ccc(cc4)N4CCCCC4)ncc3ccc2=O)C1

BDBM608575

COCC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM608576

COC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM608577

CN(C)C(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM608578

COCCS(=O)(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM608579

C=CC(=O)N1CCN(CCn2c3nc(Nc4ccc(cc4)N4CCN(CC4)S(=O)(=O)C4COC4)ncc3ccc2=O)CC1

BDBM608580

Cn1cc(Nc2ncc3ccc(=O)n(CCN4CCN(CC44CC4)C(=O)C=C)c3n2)cn1

BDBM608581

CSCC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM608582

CS(=O)(=O)CC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608583

CC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1F

BDBM608584

CC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1Cl

BDBM608585

CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1Cl

BDBM608586

C[C@H]1CN(CCN1CCn1c2nc(Nc3ccc(cc3)N3CCN(CC3)C(C)=O)ncc2ccc1=O)C(=O)C=C |r|

BDBM608587

CC(Cn1c2nc(Nc3ccc(cc3)N3CCN(CC3)C(C)=O)ncc2ccc1=O)C1CN(C1)C(=O)C=C

BDBM608588

FC1(F)CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608589

CCC[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(C)c3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608590

CCC[C@H]1CN(CCN1CCn1c2nc(Nc3ccc(cc3)N3CCN(C)CC3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608591

C[C@H]1CN(CCN1CCn1c2nc(Nc3ccc(cc3)N3CCN(C)CC3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608592

CC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4(C)CN(C4)C(=O)C=C)c3n2)cc1

BDBM608593

C[C@@H]1CN(CCN1C)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1 |r|

BDBM608594

C[C@H]1CN(C)CCN1c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1 |r|

BDBM608595

CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CC(C)(C)N4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM608596

C[C@H]1CN(CCN1C)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1 |r|

BDBM608597

CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1C

BDBM608598

C[C@H]1CN(CCN1C(C)=O)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1 |r|

BDBM608599

C[C@H]1CN(CCN1c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1)C(C)=O |r|

BDBM608600

C[C@@H]1CN(CCN1C(C)=O)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1 |r|

BDBM608601

COCCS(=O)(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(C[C@@H]4C)C(=O)C=C)c3n2)cc1 |r|

BDBM608602

CSCCC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(C[C@@H]4C)C(=O)C=C)c3n2)cc1 |r|

BDBM608603

COC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(C[C@@H]4C)C(=O)C=C)c3n2)cc1 |r|

BDBM608604

CSCC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(C[C@@H]4C)C(=O)C=C)c3n2)cc1 |r|

BDBM608605

C[C@H]1CN(CCN1CCn1c2nc(Nc3ccc(cc3)N3CCN(CC3)C(=O)N(C)C)ncc2ccc1=O)C(=O)C=C |r|

BDBM608606

COCC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(C[C@@H]4C)C(=O)C=C)c3n2)cc1 |r|

BDBM608607

C[C@H]1CN(CCN1CCn1c2nc(Nc3ccc(cc3)N3CCN(CC3)S(C)(=O)=O)ncc2ccc1=O)C(=O)C=C |r|

BDBM608608

FC(F)(F)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608609

C[C@H]1CN(C[C@@H](C)N1C(C)=O)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1 |r|

BDBM608610

CC(=O)N1CCN(CC1(C)C)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608611

CCC1(CCn2c3nc(Nc4ccc(cc4)N4CCN(CC4)C(C)=O)ncc3ccc2=O)CN(C1)C(=O)C=C

BDBM608612

CC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1F

BDBM608613

CC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1Cl

BDBM608614

CC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cn1

BDBM608615

CC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CC(C)(C)C4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608616

CC[C@H]1CN(CCN1CCn1c2nc(Nc3ccc(cc3)N3CCN(CC3)C(C)=O)ncc2ccc1=O)C(=O)C=C |r|

BDBM608617

CC[C@H]1CN(CCN1CCn1c2nc(Nc3ccc(cc3)N3CCN(CC3)C(=O)COC)ncc2ccc1=O)C(=O)C=C |r|

BDBM608618

CC[C@H]1CN(CCN1CCn1c2nc(Nc3ccc(cc3)N3CCN(CC3)C(=O)N(C)C)ncc2ccc1=O)C(=O)C=C |r|

BDBM608619

CC[C@H]1CN(CCN1CCn1c2nc(Nc3ccc(cc3)N3CCN(CC3)C(=O)CSC)ncc2ccc1=O)C(=O)C=C |r|

BDBM608620

CC[C@H]1CN(CCN1CCn1c2nc(Nc3ccc(cc3)N3CCN(CC3)S(C)(=O)=O)ncc2ccc1=O)C(=O)C=C |r|

BDBM608621

CC[C@H]1CN(CCN1CCn1c2nc(Nc3ccc(cc3)N3CCN(CC3)C(=O)OC)ncc2ccc1=O)C(=O)C=C |r|

BDBM608622

CC[C@H]1CN(CCN1CCn1c2nc(Nc3ccc(cc3)N3CCN(CC3)S(=O)(=O)CCOC)ncc2ccc1=O)C(=O)C=C |r|

BDBM608623

CC[C@H]1CN(CCN1CCn1c2nc(Nc3ccc(cc3)N3CCN(CC3)C(=O)CCSC)ncc2ccc1=O)C(=O)C=C |r|

BDBM608624

CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(C[C@@H]4CO)C(=O)C=C)c3n2)cc1 |r|

BDBM608625

CC[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(Cc4ccccc4)c3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608626

CC[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(c3)-c3ccccc3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608627

CC[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(c3)C3CCN(C)CC3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608628

CC[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(c3)C3CCOCC3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608629

CC[C@H]1CN(CCN1CCn1c2nc(Nc3ccc(cc3)N3CCN(CC3)C(=O)CS(=O)CC)ncc2ccc1=O)C(=O)C=C |r|

BDBM608631

CC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CC(C)(C)N4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM608632

CC(Cn1c2nc(Nc3ccc(cc3)N3CCN(CC3)C(C)=O)ncc2ccc1=O)N1CCN(CC1)C(=O)C=C

BDBM608633

CC[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(CCF)c3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608634

CC[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(c3)C(C)(C)COC)ncc2ccc1=O)C(=O)C=C |r|

BDBM608635

CCN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM608636

CC(C)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM608637

CCC(C)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM608638

COCCCN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM608639

COCCN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM608640

CC[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(CC(F)F)c3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608641

CSCC(=O)N1CCC(CC1)n1cc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cn1

BDBM608642

CN(C)S(=O)(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM608643

CC(C)CC(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM608644

CC(C)C(=O)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM608645

CN(C)C(=S)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM608646

CC(N1CCN(CC1)C(=O)N(C)C)c1cccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)c1

BDBM608647

CC(N1CCN(CC1)C(C)=O)c1cccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)c1

BDBM608648

CCC1(CCn2c3nc(Nc4ccc(cc4)N4CCN(C)CC4)ncc3ccc2=O)CN(C1)C(=O)C=C

BDBM608650

CC(C)(C)N1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1

BDBM608652

CC[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(CCOC(C)C)c3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608653

CCOCCn1cc(Nc2ncc3ccc(=O)n(CCN4CCN(C[C@@H]4CC)C(=O)C=C)c3n2)cn1 |r|

BDBM608655

OCCOc1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608656

CN(CCO)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608657

CN(Cc1ccccc1)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608658

Cn1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)n1

BDBM608659

C[C@H]1CN(CCN1C)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)\C=C\CN(C)C)c3n2)cc1 |r|

BDBM608660

C[C@@H]1CN(CCN1C)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)\C=C\CN(C)C)c3n2)cc1 |r|

BDBM608661

CCOCCn1cc(Nc2ncc3ccc(=O)n(CCN4CCN(C[C@@H]4C)C(=O)C=C)c3n2)cn1 |r|

BDBM608662

CC(C)OCCn1cc(Nc2ncc3ccc(=O)n(CCN4CCN(C[C@@H]4C)C(=O)C=C)c3n2)cn1 |r|

BDBM608663

C[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(c3)C3CCN(C)CC3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608664

C[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(CC(F)F)c3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608665

COCC(C)(C)n1cc(Nc2ncc3ccc(=O)n(CCN4CCN(C[C@@H]4C)C(=O)C=C)c3n2)cn1 |r|

BDBM608666

CC(Cn1c2nc(Nc3ccc(cc3)N3CCN(C)CC3)ncc2ccc1=O)C1CN(C1)C(=O)C=C

BDBM608667

C[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(c3)-c3ccccc3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608668

C[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(CCF)c3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608669

C[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(Cc4ccccc4)c3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608670

C[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(CCOC(F)F)c3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608671

C=CC(=O)N1CC(CCn2c3nc(Nc4cnn(Cc5ccccc5)c4)ncc3ccc2=O)C1

BDBM608672

CN1CCN(CC1(C)C)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608673

CCn1cc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cn1

BDBM608674

CC[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(CC)c3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608675

CCn1cc(Nc2ncc3ccc(=O)n(CCN4CCN(C[C@@H]4C)C(=O)C=C)c3n2)cn1 |r|

BDBM608676

CC[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(CCN4CCOCC4)c3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608677

C[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(CCN4CCOCC4)c3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608678

CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CC(C)(C)C4CN(C4)C(=O)C=C)c3n2)cc1

BDBM608679

C[C@H]1CN(C[C@@H](C)N1C)c1ccc(Nc2ncc3ccc(=O)n(CCC4CN(C4)C(=O)C=C)c3n2)cc1 |r|

BDBM608680

C[C@H]1CN(C[C@@H](C)N1C)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(CC4)C(=O)C=C)c3n2)cc1 |r|

BDBM608681

C[C@H]1CN(CCN1CCn1c2nc(Nc3ccc(cc3)N3C[C@H](C)N(C)[C@H](C)C3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608682

C[C@H]1CN(CCN1CCn1c2nc(Nc3cnn(c3)C3CCOCC3)ncc2ccc1=O)C(=O)C=C |r|

BDBM608683

C[C@H]1CN(CCN1C)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(C[C@@H]4C)C(=O)C=C)c3n2)cc1 |r|

BDBM608684

C[C@H]1CN(CCN1C)c1ccc(Nc2ncc3ccc(=O)n(CCN4CCN(C[C@@H]4C)C(=O)C=C)c3n2)cn1 |r|

BDBM613772

COc1c(Nc2cc(NC(=O)C(C)(C)C)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1

BDBM619040

CCC(=O)c1cnc(Nc2ccc(cn2)C(N)=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619041

CCC(=O)c1cnc(Nc2ccc(cn2)C(O)=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619042

CCC(=O)c1cnc(Nc2ccc(cn2)C(=O)NC)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619043

CCC(=O)c1cnc(Nc2ccc(cn2)C(=O)N(C)C)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619044

CCC(=O)c1cnc(Nc2cc(ccn2)C(O)=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619045

CCC(=O)c1cnc(Nc2cc(ccn2)C(N)=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619046

CCC(=O)c1cnc(Nc2cc(ccn2)C(=O)NC)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619047

CCC(=O)c1cnc(Nc2cc(ccn2)C(=O)N(C)C)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619048

CCC(=O)c1cnc(Nc2cccc(n2)C(O)=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619049

CCC(=O)c1cnc(Nc2cccc(n2)C(N)=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619050

CCC(=O)c1cnc(Nc2cccc(n2)C(=O)NC)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619051

CCC(=O)c1cnc(Nc2cccc(n2)C(=O)N(C)C)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619052

CCC(=O)c1cnc(Nc2cc(ncn2)C(N)=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619053

CCC(=O)c1cnc(Nc2cc(ncn2)C(=O)NC)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619054

CCC(=O)c1cnc(Nc2cc(ncn2)C(=O)N(C)C)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619055

CCC(=O)c1cnc(Nc2ccc(CN(C)C)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619056

CCC(=O)c1cnc(Nc2ccc(CN)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619057

CCC(=O)c1cnc(Nc2ccc(CNC)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619058

CCC(=O)c1cnc(Nc2ccc(CN(C)C)cn2)cc1Nc1cccc(-c2ncc(F)cn2)c1OC

BDBM619059

CCC(=O)c1cnc(Nc2ccc(CN(C)C)cn2)cc1Nc1cc(F)cc(-c2ncn(C)n2)c1OC

BDBM619060

COc1c(Nc2cc(Nc3ccc(CN(C)C)cn3)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1

BDBM619061

CCC(=O)c1cnc(Nc2ccc(cn2)C(C)N)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619062

CCC(=O)c1cnc(Nc2ccc(cn2)C(C)NC)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619063

CCC(=O)c1cnc(Nc2ccc(cn2)C(C)N(C)C)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619064

CCC(=O)c1cnc(Nc2ccc(cn2)[C@@H](C)N(C)C)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619065

CCC(=O)c1cnc(Nc2ccc(cn2)[C@H](C)N(C)C)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619066

CCC(=O)c1cnc(Nc2ccc(cn2)C(C)(C)N)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619067

CCC(=O)c1cnc(Nc2ccc(cn2)C(C)(C)NC)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619068

CCC(=O)c1cnc(Nc2ccc(cn2)C(C)(C)N(C)C)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619069

CCC(=O)c1cnc(Nc2ccc(cn2)C2(N)CC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619070

CCC(=O)c1cnc(Nc2ccc(cn2)C2(CC2)NC)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619071

CCC(=O)c1cnc(Nc2ccc(cn2)C2(CC2)N(C)C)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619072

CCC(=O)c1cnc(Nc2ccc(CN(C)C3CC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619074

CCC(=O)c1cnc(Nc2ccc(CN(C)C(C)C)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619075

CCN(C)Cc1ccc(Nc2cc(Nc3cccc(-c4ncn(C)n4)c3OC)c(cn2)C(=O)CC)nc1

BDBM619076

CCC(=O)c1cnc(Nc2ccc(cn2)C(N(C)C)C(F)(F)F)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619078

CCC(=O)c1cnc(Nc2ccc(CN(C)CC(F)(F)F)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619079

CCC(=O)c1cnc(Nc2ccc(CN(C)CC(F)F)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619080

CCC(=O)c1cnc(Nc2ccc(cn2)C(C)NCC(F)(F)F)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619081

CCC(=O)c1cnc(Nc2ccc(cn2)C(C)NCC(F)F)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619082

CCC(=O)c1cnc(Nc2ccc(CN(C)CC#N)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619083

CCC(=O)c1cnc(Nc2ccc(cn2)C(N)C(F)(F)F)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619084

CCC(=O)c1cnc(Nc2ccc(CN3CC(C3)OC)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619085

CCC(=O)c1cnc(Nc2ccc(CN3CC(F)C3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619086

CCC(=O)c1cnc(Nc2ccc(CN3CC(C3)C#N)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619087

CCC(=O)c1cnc(Nc2ccc(cn2)[C@H](C)N2CC(O)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619088

CCC(=O)c1cnc(Nc2ccc(cn2)[C@@H](C)N2CC(O)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619089

CCC(=O)c1cnc(Nc2ccc(CN3CCCC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619090

CCC(=O)c1cnc(Nc2ccc(CN3CC[C@@H](F)C3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619091

CCC(=O)c1cnc(Nc2ccc(CN3CC[C@H](F)C3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619092

CCC(=O)c1cnc(Nc2ccc(cn2)[C@H](C)N2CC[C@H](O)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619093

CCC(=O)c1cnc(Nc2ccc(cn2)[C@@H](C)N2CC[C@H](O)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619094

CCC(=O)c1cnc(Nc2ccc(cn2)[C@H](C)N2CC[C@@H](O)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619095

CCC(=O)c1cnc(Nc2ccc(cn2)[C@@H](C)N2CC[C@@H](O)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619096

CCC(=O)c1cnc(Nc2ccc(cn2)[C@H](C)N2C[C@@H](O)[C@H](O)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619097

CCC(=O)c1cnc(Nc2ccc(cn2)[C@@H](C)N2C[C@@H](O)[C@H](O)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619098

CCC(=O)c1cnc(Nc2ccc(CN3CCCCC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619100

CCC(=O)c1cnc(Nc2ccc(CN3CCOCC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619101

CCC(=O)c1cnc(Nc2ccc(CN3[C@@H](C)COC[C@H]3C)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC |r|

BDBM619102

CCC(=O)c1cnc(Nc2ccc(CN3C[C@H](C)O[C@H](C)C3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC |r|

BDBM619103

CCC(=O)c1cnc(Nc2ccc(CN3CCS(=O)(=O)CC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619104

CCC(=O)c1cnc(Nc2ccc(CN3CCS(=N)(=O)CC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619105

CCC(=O)c1cnc(Nc2ccc(CN3C4CC3COC4)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619106

CCC(=O)c1cnc(Nc2ccc(CN3CC4(COC4)C3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619107

CCC(=O)c1cnc(Nc2ccc(CN3CC4(CCO4)C3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619108

CCC(=O)c1cnc(Nc2ccc(cn2)[C@H](C)N2CC3(COC3)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619109

CCC(=O)c1cnc(Nc2ccc(cn2)[C@@H](C)N2CC3(COC3)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619110

CCC(=O)c1cnc(Nc2ccc(CN3CC4(C3)CCOC4)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619111

CCC(=O)c1cnc(Nc2ccc(CN(C)C3COC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619112

CCC(=O)c1cnc(Nc2ccc(CN(C)C3CC(F)(F)C3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619113

CCC(=O)c1cnc(Nc2ccc(CN)nn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619114

CCC(=O)c1cnc(Nc2ccc(CNC)nn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619115

CCC(=O)c1cnc(Nc2ccc(CN(C)C)nn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619116

CCC(=O)c1cnc(Nc2ccc(nn2)C(C)N)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619117

CCC(=O)c1cnc(Nc2ccc(nn2)C(C)NC)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619118

CCC(=O)c1cnc(Nc2ccc(nn2)C(C)N(C)C)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619119

CCC(=O)c1cnc(Nc2ccc(nn2)C(C)(C)N)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619120

CCC(=O)c1cnc(Nc2ccc(nn2)C(C)(C)NC)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619121

CCC(=O)c1cnc(Nc2ccc(nn2)C(C)(C)N(C)C)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619122

CCC(=O)c1cnc(Nc2ccc(CN3CCCC3)nn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619123

CCC(=O)c1cnc(Nc2ccc(CN3CCN(C)CC3)nn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619124

CCC(=O)c1cnc(Nc2cnc(CN)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619125

CCC(=O)c1cnc(Nc2cnc(CNC)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619126

CCC(=O)c1cnc(Nc2cnc(CN(C)C)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619127

CCC(=O)c1cnc(Nc2cnc(cn2)C(N)C(F)(F)F)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619128

CCC(=O)c1cnc(Nc2cnc(cn2)C(NC)C(F)(F)F)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619129

CCC(=O)c1cnc(Nc2cnc(cn2)C(N(C)C)C(F)(F)F)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619130

CCC(=O)c1cnc(Nc2cnc(CN(C)CC(F)(F)F)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619131

CCC(=O)c1cnc(Nc2cnc(cn2)C2(N)CC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619132

CCC(=O)c1cnc(Nc2cnc(cn2)C2(CC2)NC)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619133

CCC(=O)c1cnc(Nc2cnc(CN3CCCC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619134

CCC(=O)c1cnc(Nc2cnc(CN3CCN(C)CC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619135

CCC(=O)c1cnc(Nc2ncc(CN3CCCC3)cc2F)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619136

CCC(=O)c1cnc(Nc2ncc(CN(C)C)cc2F)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619137

CCC(=O)c1cnc(Nc2ncc(CNC)cc2F)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619138

CCC(=O)c1cnc(Nc2cccc(CN3CCCC3)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619139

CCC(=O)c1cnc(Nc2cccc(CN3CCCCC3)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619140

CCC(=O)c1cnc(Nc2cccc(CN3CCOCC3)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619141

CCC(=O)c1cnc(Nc2cc(CN3CCCC3)ccn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619142

CCC(=O)c1cnc(Nc2cc(CN3CCCCC3)ccn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619143

CCC(=O)c1cnc(Nc2cc(CN3CCOCC3)ccn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619144

CCC(=O)c1cnc(Nc2cc(CN)ncn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619145

CCC(=O)c1cnc(Nc2cc(CNC)ncn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619146

CCC(=O)c1cnc(Nc2cc(CN3CCCC3)ncn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619147

CCC(=O)c1cnc(Nc2cc(ncn2)C(C)N)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619148

CCC(=O)c1cnc(Nc2cc(ncn2)C(C)NC)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619149

CCC(=O)c1cnc(Nc2cc(ncn2)C(C)N(C)C)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619150

CCC(=O)c1cnc(Nc2ccc(CN(C)C)c(n2)C(F)(F)F)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619151

CCC(=O)c1cnc(Nc2cc(c(CN(C)C)cn2)C(F)(F)F)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619152

CCC(=O)c1cnc(Nc2nccc(CN(C)C)c2F)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619153

CCC(=O)c1cnc(Nc2nc(CN(C)C)ccc2F)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619154

CCC(=O)c1cnc(Nc2cnc(CN(C)CC(F)F)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619155

CCC(=O)c1cnc(Nc2ccc(OCCN3CCCC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619156

CCC(=O)c1cnc(Nc2ccc(CCN(C)C)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619157

CCC(=O)c1cnc(Nc2ccc(CCNC)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619158

CCC(=O)c1cnc(Nc2ccc(CCN3CCCC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619159

CCC(=O)c1cnc(Nc2ccc(CCN(C)C)nn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619160

CCC(=O)c1cnc(Nc2ccc(CCN3CCCC3)nn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619161

CCC(=O)c1cnc(Nc2cc(CCN(C)C)ncn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619162

CCC(=O)c1cnc(Nc2cc(CCN3CCCC3)ncn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619163

CCC(=O)c1cnc(Nc2cnc(CCNC)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619164

CCC(=O)c1cnc(Nc2cnc(CCN(C)C)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619165

CCC(=O)c1cnc(Nc2cnc(CCN3CCCC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619166

CCC(=O)c1cnc(Nc2ccc(cn2)S(C)(=O)=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619167

CCC(=O)c1cnc(Nc2ccc(CS(C)(=O)=O)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619168

CCC(=O)c1cnc(Nc2ccc(cn2)S(N)(=O)=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619169

CCC(=O)c1cnc(Nc2ccc(cn2)S(=O)(=O)NC)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619170

CCC(=O)c1cnc(Nc2ccc(cn2)S(=O)(=O)N(C)C)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619171

CCC(=O)c1cnc(Nc2ccc(cn2)S(=O)(=O)N2CCOCC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619172

CCC(=O)c1cnc(Nc2ccc(CS(C)(=N)=O)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619173

CCC(=O)c1cnc(Nc2ccc(cn2)S(=O)(=O)CC)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619174

CCC(=O)c1cnc(Nc2ccc(cn2)S(=O)(=O)C2CC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619175

CCC(=O)c1cnc(Nc2ccc(cn2)S(C)(=O)=O)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM619176

CCC(=O)c1cnc(Nc2ccc(cn2)S(=O)(=O)CC)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM619177

CCC(=O)c1cnc(Nc2ccc(cn2)S(=O)(=O)C2CC2)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM619178

CCC(=O)c1cnc(Nc2ccc(cn2)S(C)(=N)=O)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM619179

CCC(=O)c1cnc(Nc2ccc(CS(C)(=O)=O)cn2)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM619180

CCC(=O)c1cnc(Nc2cccc(CS(C)(=O)=O)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619181

COc1c(Nc2cc(Nc3ccc(CS(C)(=O)=O)cn3)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1

BDBM619182

CCC(=O)c1cnc(Nc2ccc(cn2)S(C)(=O)=O)cc1Nc1cccc(CO)c1OC

BDBM619183

CCC(=O)c1cnc(Nc2ccc(cn2)S(C)(=O)=O)cc1Nc1cccc(C(C)O)c1OC

BDBM619184

CCC(=O)c1cnc(Nc2ccc(cn2)S(C)(=O)=O)cc1Nc1cccc(COC)c1OC

BDBM619185

CCC(=O)c1cnc(Nc2ccc(CS(C)(=O)=O)nn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619186

CCC(=O)c1cnc(Nc2cnc(CS(C)(=O)=O)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619187

CCC(=O)c1cnc(Nc2ccc(nn2)C2(CC2)S(C)(=O)=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619188

CCC(=O)c1cnc(Nc2ccc(cn2)S(C)(=O)=O)cc1Nc1ccc(cc1OC)C(=O)N1CCCC1

BDBM619189

CCC(=O)c1cnc(Nc2ccc(cn2)S(C)(=O)=O)cc1Nc1ccc(CO)cc1OC

BDBM619190

CCC(=O)c1cnc(Nc2ccc(cn2)S(C)(=O)=O)cc1Nc1cccc(c1OC)C(C)(C)O

BDBM619191

CCC(=O)c1cnc(Nc2ncc(cc2F)S(C)(=O)=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619192

CCC(=O)c1cnc(Nc2ncc(CS(C)(=O)=O)cc2F)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619193

CCC(=O)c1cnc(Nc2ccc(cn2)S(C)(=N)=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619194

CCC(=O)c1cnc(Nc2ccc(cn2)-n2ccccc2=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619195

CCC(=O)c1cnc(Nc2ccc(cn2)-c2cn(C)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619196

CCC(=O)c1cnc(Nc2ccc(cn2)-c2ncn(C)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619197

CCC(=O)c1cnc(Nc2ccc(cn2)-c2cnn(C)c2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619198

CCC(=O)c1cnc(Nc2cc(ccn2)-c2cn(C)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619199

CCC(=O)c1cnc(Nc2cc(ccn2)-c2ncn(C)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619200

CCC(=O)c1cnc(Nc2cc(ccn2)-c2cnn(C)c2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619201

CCC(=O)c1cnc(Nc2ccc(cn2)-n2cccn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619202

CCC(=O)c1cnc(Nc2ccc(cn2)-n2ccnc2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619203

CCC(=O)c1cnc(Nc2ccc(cn2)-c2cn(C)cn2)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM619204

COc1c(Nc2cc(Nc3ccc(cn3)-c3cn(C)cn3)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1

BDBM619205

COc1c(Nc2cc(Nc3ccc(cn3)-c3cn(C)cn3)ncc2C(=O)C2CC2)nccc1-c1ncn(C)n1

BDBM619206

CCC(=O)c1cnc(Nc2ccc(cn2)-c2ncn(C)n2)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM619207

COc1c(Nc2cc(Nc3ccc(cn3)-c3ncn(C)n3)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1

BDBM619208

COc1c(Nc2cc(Nc3ccc(cn3)-c3ncn(C)n3)ncc2C(=O)C2CC2)nccc1-c1ncn(C)n1

BDBM619209

CCC(=O)c1cnc(Nc2ccc(cn2)-n2ccnc2)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM619210

COc1c(Nc2cc(Nc3ccc(cn3)-n3ccnc3)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1

BDBM619211

COc1c(Nc2cc(Nc3ccc(cn3)-n3ccnc3)ncc2C(=O)C2CC2)nccc1-c1ncn(C)n1

BDBM619212

CCC(=O)c1cnc(Nc2ccn(-c3ccccc3)c(=O)n2)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM619213

CCC(=O)c1cnc(Nc2ccn(-c3ccccc3)c(=O)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619214

CCC(=O)c1cnc(Nc2ccc(cn2)-n2ccccc2=O)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM619215

CCC(=O)c1cnc(Nc2ccc(cn2)-n2ccncc2=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619216

CCC(=O)c1cnc(Nc2ccc(cn2)-c2ccc[nH]c2=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619217

CCC(=O)c1cnc(Nc2ccc(cn2)-n2ccnc(C)c2=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619218

CCC(=O)c1cnc(Nc2ccc(cn2)-n2cnccc2=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619219

CCC(=O)c1cnc(Nc2ccc(cn2)-n2nc(C)ccc2=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619220

CCC(=O)c1cnc(Nc2ncc(cc2F)-n2ccccc2=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619221

CCC(=O)c1cnc(Nc2ccc3B(O)OCc3c2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619222

CCC(=O)c1cnc(Nc2cc3COB(O)c3cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619223

CCC(=O)c1cnc(Nc2ccc(cn2)P(C)(C)=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619224

CCC(=O)c1cnc(Nc2ccc(cn2)-c2cccn(C)c2=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619225

CCC(=O)c1cnc(Nc2cc(CN(C)C)ncn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619226

COc1c(Nc2cc(Nc3ccc(OCCO)cn3)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1

BDBM619227

COc1c(Nc2cc(Nc3ccc(OCCCO)cn3)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1

BDBM619228

CCC(=O)c1cnc(Nc2ccc(OCCOC)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619229

CCC(=O)c1cnc(Nc2ccc(OCC(C)(C)O)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619230

CCC(=O)c1cnc(Nc2ccc(OC[C@@H](O)CO)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619231

CCC(=O)c1cnc(Nc2ccc(OC[C@H](O)CO)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619232

CCC(=O)c1cnc(Nc2ccc(OC(CO)CO)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619233

COc1c(Nc2cc(Nc3ccc(OC[C@@H](O)CO)cn3)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1

BDBM619234

COc1c(Nc2cc(Nc3ccc(OC[C@H](O)CO)cn3)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1

BDBM619235

COc1c(Nc2cc(Nc3ccc(OC(CO)CO)cn3)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1

BDBM619236

CCC(=O)c1cnc(Nc2ccc(OC(C)(C)C(O)=O)c(C)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619237

CCC(=O)c1cnc(Nc2ccc(OCCO)nn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619238

CCC(=O)c1cnc(Nc2ccc(OCCCO)nn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619239

CCC(=O)c1cnc(Nc2ccnc(OCCO)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619240

CCC(=O)c1cnc(Nc2cnc(OCCO)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619241

CCC(=O)c1cnc(Nc2cnc(OCCCO)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619242

CCC(=O)c1cnc(Nc2ccc(O[C@H]3COC[C@@H]3O)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619243

CCC(=O)c1cnc(Nc2ccc(O[C@H]3CN(C)C[C@@H]3O)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619244

COc1c(Nc2cc(Nc3ccc(OCCN(C)C)cn3)ncc2C(=O)C2CC2)cccc1-c1ncn(C)n1

BDBM619245

CCC(=O)c1cnc(Nc2ccc(OC3CN(C)C3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619246

CCC(=O)c1cnc(Nc2ccc(O[C@@H]3CCN(C)C3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619247

CCC(=O)c1cnc(Nc2ccc(O[C@H]3CCN(C)C3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619249

CCC(=O)c1cnc(Nc2ccc(OC3CCN(C)CC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619250

CCC(=O)c1cnc(Nc2ccc(OC3COC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619251

CCC(=O)c1cnc(Nc2ccc(OCC3COC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619252

CCC(=O)c1cnc(Nc2ccc(O[C@@H]3CCOC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619253

CCC(=O)c1cnc(Nc2ccc(OCCN3CCCC3)nn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619254

CCC(=O)c1cnc(Nc2ccc(OCCCN3CCCC3)nn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619255

CCC(=O)c1cnc(Nc2ccc(OC3CCN(C)CC3)nn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619256

CCC(=O)c1cnc(Nc2ccc(O[C@@H]3CCN(C)C3)nn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619257

CCC(=O)c1cnc(Nc2ccc(O[C@H]3CCN(C)C3)nn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619258

CCC(=O)c1cnc(Nc2ccnc(OCCCN(C)C)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619259

CCC(=O)c1cnc(Nc2ccnc(OC3CCN(C)CC3)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619260

CCC(=O)c1cnc(Nc2ccnc(OC3CN(C)C3)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619261

CCC(=O)c1cnc(Nc2ccnc(O[C@H]3CCN(C)C3)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619262

CCC(=O)c1cnc(Nc2ccnc(O[C@@H]3CCN(C)C3)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619263

CCC(=O)c1cnc(Nc2cnc(OCCN)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619264

CCC(=O)c1cnc(Nc2cnc(OCCNC)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619265

CCC(=O)c1cnc(Nc2cnc(OC3CN(C)C3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619266

CCC(=O)c1cnc(Nc2cnc(OCCN3CC(F)C3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619267

CCC(=O)c1cnc(Nc2cnc(OCCN3CC(F)(F)C3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619268

CCC(=O)c1cnc(Nc2cnc(ON3CC(C3)C#N)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619269

CCC(=O)c1cnc(Nc2cnc(O[C@@H]3CCNC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619270

CCC(=O)c1cnc(Nc2cnc(O[C@H]3CCN(C)C3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619271

CCC(=O)c1cnc(Nc2cnc(O[C@@H]3CCN(C)C3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619272

CCC(=O)c1cnc(Nc2cnc(OCCN3CCCC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619273

CCC(=O)c1cnc(Nc2cnc(OCCCN3CCCC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619274

CCC(=O)c1cnc(Nc2cnc(OCCN3CC[C@H](F)C3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619275

CCC(=O)c1cnc(Nc2cnc(OCCN3CC[C@@H](F)C3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619276

CCC(=O)c1cnc(Nc2cnc(OCCN3CCC(F)(F)C3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619277

CCC(=O)c1cnc(Nc2cnc(O[C@H]3CN(C)C[C@@H]3F)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619278

CCC(=O)c1cnc(Nc2cnc(O[C@H]3CN(C)C[C@H]3F)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619279

CCC(=O)c1cnc(Nc2cnc(O[C@@H]3CCN(C)C3)cn2)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM619280

CCN1CC[C@H](C1)Oc1cnc(Nc2cc(Nc3cccc(-c4ncn(C)n4)c3OC)c(cn2)C(=O)CC)cn1

BDBM619281

CCC(=O)c1cnc(Nc2cnc(OC3CCN(C)CC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619282

CCC(=O)c1cnc(Nc2cnc(OCCN3CCN(C)CC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619283

CCC(=O)c1cnc(Nc2cnc(OCCN3CCOCC3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619284

CCC(=O)c1cnc(Nc2cnc(OCCn3cnc(C)c3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619285

CCC(=O)c1cnc(Nc2cnc(OCCn3ccnc3C)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619286

CCC(=O)c1cnc(Nc2cnc(O[C@@H]3CCN(C)C3)c(C)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619287

CCC(=O)c1cnc(Nc2cnc(O[C@@H]3CCN(CC(F)F)C3)c(C)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619288

CCC(=O)c1cnc(Nc2cnc(O[C@@H]3CCN(CC(F)(F)F)C3)c(C)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619289

CCC(=O)c1cnc(Nc2cnc(O[C@@H]3C[C@H](C)N(C)C3)c(C)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619291

CCC(=O)c1cnc(Nc2cnc(O[C@H]3CN[C@H](C3)C(F)F)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619292

CCC(=O)c1cnc(Nc2cnc(O[C@@H]3CCCN(C)C3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619293

CCC(=O)c1cnc(Nc2cnc(O[C@H]3CCCN(C)C3)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619294

CCC(=O)c1cnc(Nc2cnc(O[C@H]3CN(C)CC3(F)F)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619295

CCC(=O)c1cnc(Nc2cnc(O[C@@H]3CCN(C)C[C@@H]3F)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619296

CCC(=O)c1cnc(Nc2cnc(O[C@H]3CCN(C)C[C@@H]3F)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619297

CCC(=O)c1cnc(Nc2ccc(O[C@H]3CN(C)C[C@@H]3F)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619298

CCC(=O)c1cnc(Nc2ccc(O[C@@H]3CCN(C)C3)cn2)cc1Nc1cccc(-c2ncc(F)cn2)c1OC

BDBM619299

CCC(=O)c1cnc(Nc2ccc(O[C@@H]3CCN(C)C3)cn2)cc1Nc1cc(F)cc(-c2ncn(C)n2)c1OC

BDBM619300

CCC(=O)c1cnc(Nc2ncc(O[C@@H]3CCN(C)C3)cc2F)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619301

CCC(=O)c1cnc(Nc2ccc(O[C@@H]3CCN(C)C3)c(C)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619302

CCC(=O)c1cnc(Nc2ccc(OC3COC3)c(C)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619303

CCC(=O)c1cnc(Nc2ccc(O[C@@H]3CCOC3)c(C)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619304

CCC(=O)c1cnc(Nc2ncc(OC3COC3)cc2F)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619305

CCC(=O)c1cnc(Nc2ncc(OCC3COC3)cc2F)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619306

CCC(=O)c1cnc(Nc2ccc(OC3CN(C)C3)nn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619307

CCC(=O)c1cnc(Nc2cnc(cn2)C(F)(F)CN)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619308

CCC(=O)c1cnc(Nc2cnc(cn2)C(F)(F)CNC)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619309

CCC(=O)c1cnc(Nc2cnc(cn2)C(F)(F)CN(C)C)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619310

CCC(=O)c1cnc(Nc2cnc(cn2)C(F)(F)CO)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619311

CCC(=O)c1cnc(Nc2cnc(cn2)C(F)(F)CN2CCCC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619313

CCC(=O)c1cnc(Nc2ccn(n2)[C@@H]2C[C@@H](C2)OC)cc1Nc1cccc(-c2ncn(C)n2)c1OC |r,wU:14.14,16.19,(5.63,6.62,;4.09,6.62,;3.32,5.29,;4.09,3.96,;1.78,5.29,;1.01,6.62,;-.53,6.62,;-1.3,5.29,;-2.84,5.29,;-3.61,3.96,;-5.15,3.96,;-5.63,2.49,;-4.38,1.59,;-3.14,2.49,;-4.38,.05,;-5.47,-1.04,;-4.38,-2.13,;-3.29,-1.04,;-4.38,-3.67,;-3.05,-4.44,;-.53,3.96,;1.01,3.96,;1.78,2.62,;1.01,1.29,;-.53,1.29,;-1.3,-.05,;-.53,-1.38,;1.01,-1.38,;1.78,-2.71,;3.32,-2.71,;3.79,-4.18,;2.55,-5.08,;2.55,-6.62,;1.3,-4.18,;1.78,-.05,;3.32,-.05,;4.09,1.29,)|

BDBM619314

CCC(=O)c1cnc(Nc2ccn(CCOC)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619315

CCC(=O)c1cnc(Nc2ccn(CCN3CCCC3)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619316

CCC(=O)c1cnc(Nc2ccn(n2)S(=O)(=O)C2CC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619317

CCC(=O)c1cnc(Nc2ccn(n2)-c2ccccn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619318

CCC(=O)c1cnc(Nc2csc(CN3CCCC3)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619319

CCC(=O)c1cnc(Nc2cc(CN3CCCC3)n(C)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619320

CCC(=O)c1cnc(Nc2nc(CN3CCCC3)ns2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619321

CCC(=O)c1cnc(Nc2cc(CN3CCCC3)sn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619322

CCC(=O)c1cnc(Nc2ccn(n2)[C@@H]2C[C@H](O)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC |r,wU:14.14,16.17,(5.55,6.65,;4.01,6.65,;3.24,5.32,;4.01,3.99,;1.7,5.32,;.93,6.65,;-.61,6.65,;-1.38,5.32,;-2.92,5.32,;-3.69,3.99,;-5.23,3.83,;-5.55,2.32,;-4.21,1.55,;-3.07,2.58,;-4.05,.02,;-5.02,-1.18,;-3.82,-2.15,;-3.66,-3.68,;-2.85,-.95,;-.61,3.99,;.93,3.99,;1.7,2.65,;.93,1.32,;-.61,1.32,;-1.38,-.01,;-.61,-1.35,;.93,-1.35,;1.7,-2.68,;3.23,-2.86,;3.53,-4.37,;2.18,-5.13,;2,-6.65,;1.05,-4.08,;1.7,-.01,;3.24,-.01,;4.01,1.32,)|

BDBM619323

CCC(=O)c1cnc(Nc2ccn(n2)[C@H]2C[C@H](O)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC |r,wU:14.14,wD:16.17,(5.55,6.65,;4.01,6.65,;3.24,5.32,;4.01,3.99,;1.7,5.32,;.93,6.65,;-.61,6.65,;-1.38,5.32,;-2.92,5.32,;-3.69,3.99,;-5.23,3.83,;-5.55,2.32,;-4.21,1.55,;-3.07,2.58,;-4.05,.02,;-2.85,-.95,;-3.82,-2.15,;-3.66,-3.68,;-5.02,-1.18,;-.61,3.99,;.93,3.99,;1.7,2.65,;.93,1.32,;-.61,1.32,;-1.38,-.01,;-.61,-1.35,;.93,-1.35,;1.7,-2.68,;3.23,-2.86,;3.53,-4.37,;2.18,-5.13,;2,-6.65,;1.05,-4.08,;1.7,-.01,;3.24,-.01,;4.01,1.32,)|

BDBM619324

CCC(=O)c1cnc(Nc2ccn(n2)[C@H]2C[C@@H](C2)OC)cc1Nc1cccc(-c2ncn(C)n2)c1OC |r,wU:14.14,wD:16.19,(5.55,6.65,;4.01,6.65,;3.24,5.32,;4.01,3.99,;1.7,5.32,;.93,6.65,;-.61,6.65,;-1.38,5.32,;-2.92,5.32,;-3.69,3.99,;-5.23,3.83,;-5.55,2.32,;-4.21,1.55,;-3.07,2.58,;-4.05,.02,;-2.85,-.95,;-3.82,-2.15,;-5.02,-1.18,;-3.66,-3.68,;-4.91,-4.58,;-.61,3.99,;.93,3.99,;1.7,2.65,;.93,1.32,;-.61,1.32,;-1.38,-.01,;-.61,-1.35,;.93,-1.35,;1.7,-2.68,;3.23,-2.86,;3.53,-4.37,;2.18,-5.13,;2,-6.65,;1.05,-4.08,;1.7,-.01,;3.24,-.01,;4.01,1.32,)|

BDBM619325

CCC(=O)c1cnc(Nc2ccn(CCC#N)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619326

CCC(=O)c1cnc(Nc2ccn(n2)[C@@H]2C[C@@H](C2)C#N)cc1Nc1cccc(-c2ncn(C)n2)c1OC |r,wU:14.14,16.19,(5.55,6.65,;4.01,6.65,;3.24,5.32,;4.01,3.99,;1.7,5.32,;.93,6.65,;-.61,6.65,;-1.38,5.32,;-2.92,5.32,;-3.69,3.99,;-5.23,3.83,;-5.55,2.32,;-4.21,1.55,;-3.07,2.58,;-4.05,.02,;-5.02,-1.18,;-3.82,-2.15,;-2.85,-.95,;-3.66,-3.68,;-3.5,-5.21,;-.61,3.99,;.93,3.99,;1.7,2.65,;.93,1.32,;-.61,1.32,;-1.38,-.01,;-.61,-1.35,;.93,-1.35,;1.7,-2.68,;3.23,-2.86,;3.53,-4.37,;2.18,-5.13,;2,-6.65,;1.05,-4.08,;1.7,-.01,;3.24,-.01,;4.01,1.32,)|

BDBM619327

CCC(=O)c1cnc(Nc2ccn(n2)[C@H]2C[C@@H](C2)C#N)cc1Nc1cccc(-c2ncn(C)n2)c1OC |r,wU:14.14,wD:16.19,(5.55,6.65,;4.01,6.65,;3.24,5.32,;4.01,3.99,;1.7,5.32,;.93,6.65,;-.61,6.65,;-1.38,5.32,;-2.92,5.32,;-3.69,3.99,;-5.23,3.83,;-5.55,2.32,;-4.21,1.55,;-3.07,2.58,;-4.05,.02,;-2.85,-.95,;-3.82,-2.15,;-5.02,-1.18,;-3.66,-3.68,;-3.5,-5.21,;-.61,3.99,;.93,3.99,;1.7,2.65,;.93,1.32,;-.61,1.32,;-1.38,-.01,;-.61,-1.35,;.93,-1.35,;1.7,-2.68,;3.23,-2.86,;3.53,-4.37,;2.18,-5.13,;2,-6.65,;1.05,-4.08,;1.7,-.01,;3.24,-.01,;4.01,1.32,)|

BDBM619328

CCC(=O)c1cnc(Nc2cn(cn2)[C@@H]2C[C@H](O)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC |r,wU:14.14,16.17,(7.95,6.65,;6.41,6.65,;5.64,5.32,;6.41,3.99,;4.1,5.32,;3.33,6.65,;1.79,6.65,;1.02,5.32,;-.52,5.32,;-1.29,3.99,;-2.82,3.83,;-3.14,2.32,;-1.81,1.55,;-.67,2.58,;-4.55,1.69,;-5.99,2.25,;-6.54,.81,;-7.95,.18,;-5.1,.26,;1.79,3.99,;3.33,3.99,;4.1,2.65,;3.33,1.32,;1.79,1.32,;1.02,-.01,;1.79,-1.35,;3.33,-1.35,;4.1,-2.68,;5.63,-2.86,;5.93,-4.37,;4.58,-5.13,;4.4,-6.65,;3.45,-4.08,;4.1,-.01,;5.64,-.01,;6.41,1.32,)|

BDBM619329

CCC(=O)c1cnc(Nc2ccn(CC3(C)COC3)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619330

CCC(=O)c1cnc(Nc2ccn(CC3COC3)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619331

CCC(=O)c1cnc(Nc2ccn(CC3CCCO3)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619332

CCC(=O)c1cnc(Nc2ccn(CC3CCOC3)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619333

CCC(=O)c1cnc(Nc2ccn(CC3(CO)COC3)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619334

CCC(=O)c1cnc(Nc2ccn(CC3CCO3)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619335

CCC(=O)c1cnc(Nc2ccn(C[C@@H]3C[C@H](O)C3)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC |r,wU:14.13,16.16,(6.93,6.65,;5.39,6.65,;4.62,5.32,;5.39,3.98,;3.08,5.32,;2.31,6.65,;.77,6.65,;-0,5.32,;-1.54,5.32,;-2.31,3.98,;-3.85,3.82,;-4.17,2.32,;-2.83,1.55,;-2.67,.02,;-3.92,-.89,;-5.44,-.65,;-5.68,-2.17,;-6.93,-3.07,;-4.16,-2.41,;-1.69,2.58,;.77,3.98,;2.31,3.98,;3.08,2.65,;2.31,1.32,;.77,1.32,;-0,-.02,;.77,-1.35,;2.31,-1.35,;3.08,-2.68,;4.61,-2.84,;4.93,-4.35,;3.59,-5.12,;3.43,-6.65,;2.45,-4.09,;3.08,-.02,;4.62,-.02,;5.39,1.32,)|

BDBM619336

CCC(=O)c1cnc(Nc2ccn(CC3CN(C)C3)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619337

CCC(=O)c1cnc(Nc2cc(OC)n(CCOC)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619338

CCC(=O)c1cnc(Nc2cc(C)n(CCOC)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619339

CCC(=O)c1cnc(Nc2cc(OCCO)n(C)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619340

CCC(=O)c1cnc(Nc2ccn(n2)[C@@H]2C[C@@H](C2)OC(F)F)cc1Nc1cccc(-c2ncn(C)n2)c1OC |r,wU:14.14,16.19,(5.48,6.62,;3.94,6.62,;3.15,5.3,;3.94,3.98,;1.61,5.3,;.86,6.65,;-.68,6.68,;-1.47,5.36,;-3.01,5.36,;-3.81,4.01,;-5.33,3.67,;-5.48,2.11,;-4.05,1.49,;-3.01,2.66,;-3.71,-.01,;-4.54,-1.31,;-3.24,-2.14,;-2.41,-.84,;-2.91,-3.64,;-4.04,-4.68,;-4.04,-6.22,;-5.45,-4.06,;-.73,4.01,;.81,3.98,;1.61,2.63,;.84,1.3,;-.7,1.3,;-1.47,-.03,;-.7,-1.37,;.84,-1.37,;1.61,-2.7,;3.1,-3.1,;3.18,-4.64,;1.74,-5.19,;1.34,-6.68,;.77,-3.99,;1.61,-.03,;3.15,-.03,;3.92,1.3,)|

BDBM619341

CCO[C@H]1C[C@H](C1)n1ccc(Nc2cc(Nc3cccc(-c4ncn(C)n4)c3OC)c(cn2)C(=O)CC)n1 |r,wU:5.7,3.2,(-3.75,-6.18,;-4.07,-4.67,;-2.93,-3.64,;-3.26,-2.13,;-4.55,-1.3,;-3.72,-0,;-2.43,-.84,;-4.05,1.5,;-5.47,2.13,;-5.31,3.67,;-3.79,4,;-3.01,5.34,;-1.47,5.34,;-.71,4,;.82,3.99,;1.61,2.65,;.84,1.31,;-.71,1.33,;-1.51,-0,;-.71,-1.36,;.84,-1.36,;1.61,-2.69,;3.09,-3.09,;3.17,-4.63,;1.74,-5.18,;1.34,-6.66,;.77,-3.98,;1.61,-.02,;3.15,-.02,;3.92,1.31,;1.61,5.31,;.85,6.65,;-.69,6.66,;3.15,5.31,;3.93,3.99,;3.93,6.64,;5.47,6.64,;-3.01,2.66,)|

BDBM619342

CCC(=O)c1cnc(Nc2cc(C)n(n2)[C@@H]2C[C@H](O)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC |r,wU:15.15,17.18,(6.29,6.61,;4.75,6.61,;3.95,5.29,;4.75,3.98,;2.41,5.29,;1.67,6.65,;.13,6.68,;-.67,5.36,;-2.21,5.36,;-3.01,4.01,;-4.54,3.87,;-4.88,2.37,;-6.29,1.76,;-3.55,1.58,;-2.4,2.6,;-3.41,.05,;-4.39,-1.14,;-3.2,-2.12,;-3.06,-3.65,;-2.22,-.93,;.07,4.01,;1.61,3.98,;2.41,2.63,;1.64,1.3,;.07,1.35,;-.76,.01,;-.02,-1.37,;1.64,-1.37,;2.41,-2.7,;3.9,-3.1,;3.98,-4.64,;2.54,-5.19,;2.14,-6.68,;1.57,-4,;2.41,-.04,;3.95,-.04,;4.72,1.3,)|

BDBM619343

CCC(=O)c1cnc(Nc2cc(C)n(n2)[C@@H]2C[C@@H](C2)OC)cc1Nc1cccc(-c2ncn(C)n2)c1OC |r,wU:15.15,17.20,(6.24,6.65,;4.7,6.65,;3.93,5.32,;4.7,3.98,;2.39,5.32,;1.62,6.65,;.08,6.65,;-.69,5.32,;-2.23,5.32,;-3,3.98,;-4.53,3.82,;-4.84,2.31,;-6.24,1.68,;-3.5,1.54,;-2.36,2.58,;-3.34,.01,;-4.31,-1.18,;-3.1,-2.15,;-2.13,-.95,;-2.93,-3.68,;-4.18,-4.59,;.08,3.98,;1.62,3.98,;2.39,2.65,;1.62,1.32,;.08,1.32,;-.69,-.02,;.08,-1.35,;1.62,-1.35,;2.39,-2.68,;3.93,-2.84,;4.25,-4.35,;2.91,-5.12,;2.75,-6.65,;1.77,-4.09,;2.39,-.02,;3.93,-.02,;4.7,1.32,)|

BDBM619344

CCO[C@H]1C[C@H](C1)n1nc(Nc2cc(Nc3cccc(-c4ncn(C)n4)c3OC)c(cn2)C(=O)CC)cc1C |r,wU:5.7,3.2,(-4.07,-6.11,;-4.23,-4.58,;-2.98,-3.68,;-3.14,-2.14,;-4.33,-1.17,;-3.36,.02,;-2.17,-.95,;-3.52,1.55,;-2.37,2.58,;-2.99,3.99,;-2.22,5.33,;-.68,5.33,;.09,3.99,;1.63,3.98,;2.4,2.65,;1.63,1.31,;.09,1.32,;-.7,-.01,;.09,-1.35,;1.63,-1.35,;2.4,-2.69,;3.93,-2.85,;4.25,-4.36,;2.92,-5.13,;2.76,-6.66,;1.78,-4.1,;2.4,-.02,;3.94,-.02,;4.71,1.31,;2.4,5.31,;1.64,6.65,;.1,6.66,;3.94,5.31,;4.72,3.98,;4.72,6.64,;6.26,6.64,;-4.53,3.83,;-4.85,2.33,;-6.26,1.7,)|

BDBM619345

CCC(=O)c1cnc(Nc2ccn(n2)C2CC(F)(F)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619346

CCC(=O)c1cnc(NC(=O)C2CC2c2cnn(C)c2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619347

CCC(=O)c1cnc(NC(=O)C2CC2c2ccccn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619348

CCC(=O)c1cnc(NC(=O)[C@@H]2C[C@H]2C(O)=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619349

CCC(=O)c1cnc(NC(=O)[C@@H]2C[C@H]2CN(C)C)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619350

CCC(=O)c1cnc(NC(=O)[C@@H]2C[C@H]2C(N)=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619351

CCC(=O)c1cnc(NC(=O)[C@@H]2C[C@@H]2C(N)=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619353

CCC(=O)c1cnc(NC(=O)[C@@H]2C[C@H]2NC(=O)OC(C)(C)C)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619354

CCC(=O)c1cnc(NC(=O)[C@@H]2C[C@H]2NC(C)=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619355

CCC(=O)c1cnc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619356

CCC(=O)c1cnc(NC(=O)[C@@H]2C[C@@H]2NC(C)=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619357

CCC(=O)c1cnc(NC(=O)[C@@H]2C[C@H]2CC#N)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619358

CCC(=O)c1cnc(NC(=O)C2CC2c2ccn(C)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619359

CCC(=O)c1cnc(NC(=O)[C@@H]2C[C@H]2CS(C)(=O)=O)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619360

CCC(=O)c1cnc(NC(=O)CC2CCN(C)CC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619361

CCC(=O)c1cnc(NC(=O)CC2CC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619362

CCC(=O)c1cnc(NC(=O)CC2(O)CC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619363

CCC(=O)c1cnc(NC(=O)CCN2CCCC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619364

CCC(=O)c1cnc(NC(=O)CCCN2CCCC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619365

CCC(=O)c1cnc(NC(=O)CCc2cnn(C)c2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619366

CCC(=O)c1cnc(NC(=O)CC2CN(C)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619367

CCC(=O)c1cnc(NC(=O)CCNC)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619368

CCC(=O)c1cnc(Nc2cc(OCCOC)n(C)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM619369

CCC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cc(F)cc(-c2ncn(C)n2)c1OC

BDBM619370

CCC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cc(cc(-c2ncn(C)n2)c1OC)C#N

BDBM619371

CCC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cc(CN(C)C)cc(-c2ncn(C)n2)c1OC

BDBM619372

CCC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cc(CO)cc(-c2ncn(C)n2)c1OC

BDBM619373

CCC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cc(COC)cc(-c2ncn(C)n2)c1OC

BDBM619374

CCC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cc(F)cc(-c2ncn(CCO)n2)c1OC

BDBM619375

CCC(=O)c1cnc(NC2=NN(CC2)C(=O)C2CC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC |t:9|

BDBM624837

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC3(COC3)C#N)n2)n[nH]1 |TLB:23:22:18.19:15.16.21|

BDBM624842

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4C[C@H]3COC(=O)O3)n2)n[nH]1 |r,TLB:23:22:19.18:15.21.16|

BDBM624863

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C3CCOC3=O)n2)n[nH]1 |THB:24:23:18.19.20:15.16.22|

BDBM624864

Cc1cc(Nc2cc3ncccc3c(N[C@@H]3C[C@@H]4CCC[C@H](C3)N4C3CCOC3=O)n2)n[nH]1 |THB:24:23:18.19.20:15.16.22|

BDBM624868

Cc1cc(Nc2cc3ncccc3c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4Cc3cnccc3C#N)n2)n[nH]1 |THB:24:23:18.19.20:15.16.22|

BDBM624899

CC(CC#N)CC(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |TLB:6:8:10.11.12:14.15.16|

BDBM624913

CCC(C)COC(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncccc12 |TLB:6:8:10.11.12:14.15.16|

BDBM624952

COc1ccc2c(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CCC#N)nc(Nc3cc(C)[nH]n3)cc2n1 |r,TLB:16:15:9.8.14:12.11|

BDBM624954

COc1ccc2c(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)CCC#N)nc(Nc3cc(C)[nH]n3)cc2n1 |THB:17:16:11.12.13:8.9.15|

BDBM624968

COCCS(=O)(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2nc(CN3CCOCC3)ccc12 |TLB:4:7:9.10:13.14.12|

BDBM624971

Cc1cc(Nc2cc3nc(CN4CCOCC4)ccc3c(N[C@H]3C[C@@H]4CC[C@H](C3)N4S(=O)(=O)c3cccnc3)n2)n[nH]1 |TLB:30:29:25.26:22.23.28|

BDBM624983

CN1CCN(Cc2ccc3c(N[C@H]4C[C@@H]5CC[C@H](C4)N5S(=O)(=O)C4CCC4)nc(Nc4cc(C)[nH]n4)cc3n2)CC1 |TLB:20:19:15.16:12.13.18|

BDBM625014

COc1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C(=O)C(O)(CF)SC)c2c1 |THB:27:26:21.22.23:18.19.25|

BDBM625028

COC(=O)c1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CC[C@H](C3)N4C(=O)OCC(C)C)c2c1 |r,TLB:28:27:21.20.26:24.23|

BDBM625029

CNOC(=O)CN1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncc(cc12)C(=O)OC |r,TLB:5:6:13.12.11:9.8|

BDBM625035

COC(=O)c1cnc2cc(Nc3cc(C)[nH]n3)nc(N[C@H]3C[C@@H]4CCC[C@H](C3)N4C3CCCOC3=O)c2c1 |THB:29:28:23.24.25:20.21.27|

BDBM625040

CCC(C)C(=S)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)cc2ncc(cc12)S(C)(=O)=O |r,TLB:4:6:13.12.11:9.8|

BDBM625065

COC(=S)C(=O)N1[C@H]2CC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)c(F)c2ncccc12 |THB:4:6:8.9:11.12.13|

BDBM625073

COC(=S)C(=O)N1[C@H]2CCC[C@@H]1C[C@H](C2)Nc1nc(Nc2cc(C)[nH]n2)c(F)c2ncccc12 |r,TLB:4:6:10.9.8:13.12.14|

BDBM50598704

[H][C@]12OC[C@H](Oc3nc(Nc4ccc(N5CCC(CC5)N5CCN(C)CC5)c(Cl)c4)ncc3Cl)[C@@]1([H])OC[C@H]2O |r|

BDBM50598706

[H][C@]12OC[C@@H](Oc3nc(Nc4ccc(N5CCC(CC5)N5CCN(C)CC5)c(Cl)c4)ncc3Cl)[C@@]1([H])OC[C@H]2O |r|

BDBM633187

CN1CCN(CC1)C1CCN(CC1)c1ccc(Nc2ncc(Cl)c(O[C@@H]3CO[C@@H]4[C@H](O)CO[C@H]34)n2)cc1 |r|

BDBM633188

COc1cc(Nc2ncc(Cl)c(O[C@@H]3CO[C@@H]4[C@H](O)CO[C@H]34)n2)ccc1N1CCC(CC1)N1CCN(C)CC1 |r|

BDBM50598707

[H][C@]12OC[C@@H](Oc3nc(Nc4ccc(N5CCC(CC5)N5CCN(C)CC5)c(NC(=O)C=C)c4)ncc3Cl)[C@@]1([H])OC[C@H]2O |r|

BDBM50598708

[H][C@]12OC[C@@H](Oc3nc(Nc4cccc(NC(=O)C=C)c4)ncc3Cl)[C@@]1([H])OC[C@H]2O |r|

BDBM633196

O[C@@H]1CO[C@@H]2[C@@H](CO[C@H]12)Oc1nc(Nc2ccc(F)c(NC(=O)C=C)c2)ncc1Cl |r|

BDBM50598712

[H][C@]12OC[C@@H](Oc3nc(Nc4ccc(N5CCOCC5)c(NC(=O)C=C)c4)ncc3Cl)[C@@]1([H])OC[C@H]2O |r|

BDBM633198

CN(CCO)c1ccc(Nc2ncc(Cl)c(O[C@@H]3CO[C@@H]4[C@H](O)CO[C@H]34)n2)cc1NC(=O)C=C |r|

BDBM633199

C\C=C\C(=O)Nc1cc(Nc2ncc(Cl)c(O[C@@H]3CO[C@@H]4[C@H](O)CO[C@H]34)n2)ccc1N1CCC(CC1)N1CCN(C)CC1 |r|

BDBM633200

CN1CCN(CC1)C1CCN(CC1)c1ccc(Nc2ncc(Cl)c(O[C@@H]3CO[C@@H]4[C@H](O)CO[C@H]34)n2)cc1NC(=O)C(C)=C |r|

BDBM633201

CN(C)C\C=C\C(=O)Nc1cc(Nc2ncc(Cl)c(O[C@@H]3CO[C@@H]4[C@H](O)CO[C@H]34)n2)ccc1N1CCC(CC1)N1CCN(C)CC1 |r|

BDBM50598716

[H][C@]12OC[C@@H](Oc3nc(Nc4ccc(N(C)CCN(C)C)c(NC(=O)C=C)c4)ncc3Cl)[C@@]1([H])OC[C@H]2O |r|

BDBM50598709

[H][C@]12OC[C@@H](Oc3nc(Nc4ccc(N5CCC6(CCN(C)CC6)CC5)c(NC(=O)C=C)c4)ncc3Cl)[C@@]1([H])OC[C@H]2O |r|

BDBM50598713

[H][C@]12OC[C@@H](Oc3nc(Nc4ccc(N5CCC(CC5)N(C)C)c(NC(=O)C=C)c4)ncc3Cl)[C@@]1([H])OC[C@H]2O |r|

BDBM633205

CN1CCN(CC1)C1CCN(CC1)c1ccc(Nc2ncc(Cl)cn2)cc1NC(=O)C=C

BDBM633206

CN1CCN(CC1)C1CCN(CC1)c1ccc(Nc2ncc(C)c(O[C@@H]3CO[C@@H]4[C@H](O)CO[C@H]34)n2)cc1NC(=O)C=C |r|

BDBM50598714

[H][C@]12OC[C@@H](Oc3nc(Nc4ccc(N5CCN(CC)CC5)c(NC(=O)C=C)c4)ncc3Cl)[C@@]1([H])OC[C@H]2O |r|

BDBM50598715

[H][C@]12OC[C@@H](Oc3nc(Nc4ccc(N5CCC(C5)N(C)C)c(NC(=O)C=C)c4)ncc3Cl)[C@@]1([H])OC[C@H]2O |r|

BDBM50598711

[H][C@]12CN(c3ccc(Nc4ncc(Cl)c(O[C@@H]5CO[C@]6([H])[C@H](O)CO[C@]56[H])n4)cc3NC(=O)C=C)[C@]([H])(CO1)C2 |r|

BDBM50598710

[H][C@@]12CN(c3ccc(Nc4ncc(Cl)c(O[C@@H]5CO[C@]6([H])[C@H](O)CO[C@]56[H])n4)cc3NC(=O)C=C)[C@@]([H])(CN1C)C2 |r|

BDBM633211

CO[C@@H]1CO[C@@H]2[C@@H](CO[C@H]12)Oc1nc(Nc2ccc(N3CCC(CC3)N3CCN(C)CC3)c(NC(=O)C=C)c2)ncc1Cl |r|

BDBM50598717

[H][C@]12OC[C@@H](Oc3nc(Nc4ccc(N(C)CCN(C)C)c(NC(=O)C=C)c4)ncc3Cl)[C@@]1([H])OC[C@H]2OC |r|

BDBM633213

CO[C@@H]1CO[C@@H]2[C@@H](CO[C@H]12)Oc1nc(Nc2ccc(N3CCOCC3)c(NC(=O)C=C)c2)ncc1Cl |r|

BDBM633214

CO[C@@H]1CO[C@@H]2[C@@H](CO[C@H]12)Oc1nc(Nc2ccc(N3CCN(C)[C@@H](C)C3)c(NC(=O)C=C)c2)ncc1Cl |r|

BDBM633217

CN1CCN(CC1)C1CCN(CC1)c1ccc(Nc2ncc(Cl)c(O[C@@H]3CO[C@@H]4[C@@H](F)CO[C@H]34)n2)cc1NC(=O)C=C |r|

BDBM50598720

[H][C@]12OC[C@@H](Oc3nc(Nc4ccc(N(C)CCN(C)C)c(NC(=O)C=C)c4)ncc3Cl)[C@@]1([H])OC[C@@H]2F |r|

BDBM633219

CCN1CCN(CC1)c1ccc(Nc2ncc(Cl)c(O[C@@H]3CO[C@@H]4[C@@H](F)CO[C@H]34)n2)cc1NC(=O)C=C |r|

BDBM50598721

[H][C@]12OC[C@@H](Oc3nc(Nc4ccc(N(C)CCN(C)C)c(NC(=O)C=C)c4)ncc3Cl)[C@@]1([H])OC[C@H]2F |r|

BDBM633221

CCN1CCN(CC1)c1ccc(Nc2ncc(Cl)c(O[C@@H]3CO[C@@H]4[C@H](F)CO[C@H]34)n2)cc1NC(=O)C=C |r|

BDBM50598722

[H][C@]12OCC(F)(F)[C@@]1([H])OC[C@H]2Oc1nc(Nc2ccc(N(C)CCN(C)C)c(NC(=O)C=C)c2)ncc1Cl |r|

BDBM633223

CN(C)CCN(C)c1ccc(Nc2ncc(Cl)c(O[C@@H]3CO[C@@H]4CCO[C@H]34)n2)cc1NC(=O)C=C |r|

BDBM50598718

[H][C@]12OC[C@@H](Oc3nc(Nc4ccc(N(C)CCN(C)C)c(NC(=O)C=C)c4)ncc3Cl)[C@@]1([H])OC[C@H]2OCC |r|

BDBM50598719

[H][C@]12OC[C@@H](Oc3nc(Nc4ccc(N(C)CCN(C)C)c(NC(=O)C=C)c4)ncc3Cl)[C@@]1([H])OC[C@H]2OC(C)C |r|

BDBM488640

CC1CCN(CC1N(C)c1ncnc2[nH]ccc12)C(=O)CC#N

BDBM633261

CO[C@]1(CCOC1)c1cccc(n1)-c1cn(C)c2cnc(NC(N)=O)cc12 |r|

BDBM633262

CO[C@@]1(CCOC1)c1cccc(n1)-c1cn(C)c2cnc(NC(N)=O)cc12 |r|

BDBM633263

CO[C@]1(CCOC1)c1cccc(n1)-c1cn([C@@H]2CC2(F)F)c2cnc(NC(N)=O)cc12 |r|

BDBM633264

CO[C@]1(CCOC1)c1cccc(n1)-c1cn([C@H]2CC2(F)F)c2cnc(NC(N)=O)cc12 |r|

BDBM633265

CNC(=O)Nc1cc2c(cn(C)c2cn1)-c1cccc(n1)[C@@]1(CCOC1)OC |r|

BDBM633266

CO[C@]1(CCOC1)c1cc(C)cc(n1)-c1cn(C)c2cnc(NC(N)=O)cc12 |r|

BDBM633267

CO[C@@]1(CCOC1)c1cc(C)cc(n1)-c1cn(C)c2cnc(NC(N)=O)cc12 |r|

BDBM633268

COC1(COC1)c1cccc(n1)-c1cn(C)c2cnc(NC(N)=O)cc12

BDBM633269

Cn1cc(-c2cncc(n2)[C@]2(C)CCOC2)c2cc(NC(N)=O)ncc12 |r|

BDBM633270

Cn1cc(-c2cncc(n2)[C@@]2(C)CCOC2)c2cc(NC(N)=O)ncc12 |r|

BDBM633271

COCc1cc(nc(c1)[C@@]1(CCOC1)OC)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633272

COCc1cc(nc(c1)[C@@]1(CCOC1)OC)-c1c[nH]c2cnc(NC(C)=O)cc12 |r|

BDBM633273

CO[C@]1(CCOC1)c1cc(C)cc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633274

CC[C@]1(CCOC1)c1cccc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633275

CC[C@@]1(CCOC1)c1cccc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633276

COCc1cc(nc(c1)[C@]1(CCOC1)OC)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633277

CO[C@@]1(CCOC1)c1cc(cc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12)C#N |r|

BDBM633278

CO[C@]1(CCOC1)c1cc(cc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12)C#N |r|

BDBM633279

CO[C@@]1(CCOC1)c1cc(cc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12)C(F)F |r|

BDBM633280

CO[C@]1(CCOC1)c1cc(cc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12)C(F)F |r|

BDBM633281

CO[C@@]1(CCOC1)c1cncc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633282

CO[C@]1(CCOC1)c1cncc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633283

CC[C@@]1(CCOC1)c1cc(cc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12)C#N |r|

BDBM633284

CO[C@@]1(CCOC1)c1cc(cc(n1)-c1cn([C@@H]2CC2(F)F)c2cnc(NC(C)=O)cc12)C#N |r|

BDBM633285

CO[C@@]1(CCOC1)c1cc(cc(n1)-c1cn([C@H]2CC2(F)F)c2cnc(NC(C)=O)cc12)C#N |r|

BDBM633286

CO[C@]1(CCOC1)c1cc(cc(n1)-c1cn([C@@H]2CC2(F)F)c2cnc(NC(C)=O)cc12)C#N |r|

BDBM633287

CO[C@]1(CCOC1)c1cc(cc(n1)-c1cn([C@H]2CC2(F)F)c2cnc(NC(C)=O)cc12)C#N |r|

BDBM633288

COCc1cc(nc(c1)[C@@]1(CCOC1)OC)-c1cn(C)c2cnc(NC(N)=O)cc12 |r|

BDBM633289

CC[C@]1(CCOC1)c1cccc(n1)-c1cn(C)c2cnc(NC(N)=O)cc12 |r|

BDBM633290

CC[C@@]1(CCOC1)c1cccc(n1)-c1cn(C)c2cnc(NC(N)=O)cc12 |r|

BDBM633291

COCc1cc(nc(c1)[C@@]1(CCOC1)OC)-c1cn(C2COC2)c2cnc(NC(C)=O)cc12 |r|

BDBM633292

CO[C@@]1(CCOC1)c1cc(cc(n1)-c1cn(C2COC2)c2cnc(NC(C)=O)cc12)C(F)F |r|

BDBM633293

CO[C@]1(CCOC1)c1cc(cc(n1)-c1cn(C2COC2)c2cnc(NC(C)=O)cc12)C(F)F |r|

BDBM633294

COc1cc(nc(c1)[C@]1(CCOC1)OC)-c1cn(C2COC2)c2cnc(NC(C)=O)cc12 |r|

BDBM633295

COc1cc(nc(c1)[C@@]1(CCOC1)OC)-c1cn(C2COC2)c2cnc(NC(C)=O)cc12 |r|

BDBM633296

COc1cc(nc(c1)[C@@]1(CCOC1)OC)-c1cn([C@@H]2CCOC2)c2cnc(NC(C)=O)cc12 |r|

BDBM633297

COc1cc(nc(c1)[C@]1(CCOC1)OC)-c1cn([C@@H]2CCOC2)c2cnc(NC(C)=O)cc12 |r|

BDBM633298

CO[C@]1(CCOC1)c1cc(OCC2COC2)cc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633299

CO[C@@]1(CCOC1)c1cc(OCC2COC2)cc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633300

CO[C@]1(CCOC1)c1cc(OCC#N)cc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633301

CO[C@]1(CCOC1)c1cc(OCC[C@@H](C)O)cc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633302

CO[C@]1(CCOC1)c1cc(OC2COC2)cc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633303

CO[C@]1(CCOC1)c1cc(OCC[C@H](C)O)cc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633304

CO[C@]1(CCOC1)c1cc(OCCO)cc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633305

CO[C@]1(CCOC1)c1cc(O[C@H]2C[C@H](O)C2)cc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r,wU:13.14,wD:11.11,2.1,(1.37,4.87,;.97,3.38,;-.51,2.98,;-.99,4.44,;-2.53,4.44,;-3.01,2.98,;-1.76,2.07,;.57,1.89,;2.06,2.29,;3.15,1.2,;4.64,1.6,;5.41,2.93,;6.9,3.33,;6.5,4.82,;7.27,6.15,;5.01,4.42,;2.75,-.29,;1.26,-.69,;.18,.4,;.87,-2.17,;1.77,-3.42,;.87,-4.66,;1.26,-6.15,;-.6,-4.19,;-1.93,-4.96,;-3.27,-4.19,;-3.27,-2.65,;-4.6,-1.88,;-5.93,-2.65,;-7.27,-1.88,;-5.93,-4.19,;-1.93,-1.88,;-.6,-2.65,)|

BDBM633306

CO[C@@]1(CCOC1)c1cc(O[C@H]2C[C@H](O)C2)cc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r,wU:2.1,13.14,wD:11.11,(1.37,4.87,;.97,3.38,;-.51,2.98,;-.99,4.44,;-2.53,4.44,;-3.01,2.98,;-1.76,2.07,;.57,1.89,;2.06,2.29,;3.15,1.2,;4.64,1.6,;5.41,2.93,;6.9,3.33,;6.5,4.82,;7.27,6.15,;5.01,4.42,;2.75,-.29,;1.26,-.69,;.18,.4,;.87,-2.17,;1.77,-3.42,;.87,-4.66,;1.26,-6.15,;-.6,-4.19,;-1.93,-4.96,;-3.27,-4.19,;-3.27,-2.65,;-4.6,-1.88,;-5.93,-2.65,;-7.27,-1.88,;-5.93,-4.19,;-1.93,-1.88,;-.6,-2.65,)|

BDBM633307

CO[C@]1(CCOC1)c1cc(O[C@@H]2C[C@H](O)C2)cc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r,wU:11.11,13.14,wD:2.1,(1.82,4.6,;1.42,3.12,;-.07,2.72,;.41,4.18,;-.84,5.09,;-2.08,4.18,;-1.61,2.72,;1.02,1.63,;2.51,2.03,;3.6,.94,;5.09,1.34,;5.49,2.82,;6.82,3.59,;6.05,4.93,;6.45,6.42,;4.72,4.16,;3.2,-.55,;1.71,-.95,;.62,.14,;1.31,-2.44,;2.22,-3.68,;1.31,-4.93,;1.71,-6.42,;-.15,-4.45,;-1.48,-5.22,;-2.82,-4.45,;-2.82,-2.91,;-4.15,-2.14,;-5.49,-2.91,;-6.82,-2.14,;-5.49,-4.45,;-1.48,-2.14,;-.15,-2.91,)|

BDBM633308

CO[C@]1(CCOC1)c1cncc(n1)-c1cn(C)c2cnc(NC(N)=O)cc12 |r|

BDBM633309

CO[C@@]1(CCOC1)c1cc(cc(n1)-c1cn(C)c2cnc(NC(N)=O)cc12)C#N |r|

BDBM633310

CO[C@]1(CCOC1)c1cc(cc(n1)-c1cn(C)c2cnc(NC(N)=O)cc12)C#N |r|

BDBM633311

COCc1cc(nc(c1)[C@]1(CCOC1)OC)-c1cn(C)c2cnc(NC(N)=O)cc12 |r|

BDBM633312

CO[C@]1(CCOC1)c1cc(cc(n1)-c1cn(C)c2cnc(NC(N)=O)cc12)C(F)F |r|

BDBM633313

COc1cc(nc(c1)[C@@]1(CCOC1)OC)-c1cn(C)c2cnc(NC(N)=O)cc12 |r|

BDBM633314

COc1cc(nc(c1)[C@]1(CCOC1)OC)-c1cn(C)c2cnc(NC(N)=O)cc12 |r|

BDBM633315

CO[C@]1(CCOC1)c1cc(cc(n1)-c1cn([C@H]2CC2(F)F)c2cnc(NC(N)=O)cc12)C#N |r|

BDBM633316

CO[C@]1(CCOC1)c1cc(cc(n1)-c1cn([C@@H]2CC2(F)F)c2cnc(NC(N)=O)cc12)C#N |r|

BDBM633317

CO[C@]1(CCOC1)c1cc(cc(n1)-c1cn([C@@H]2CCOC2)c2cnc(NC(N)=O)cc12)C(F)F |r|

BDBM633318

CO[C@]1(CCOC1)c1cc(cc(n1)-c1cn([C@H]2CCOC2)c2cnc(NC(N)=O)cc12)C(F)F |r|

BDBM633319

CO[C@]1(CCOC1)c1cc(cc(n1)-c1cn(C2COC2)c2cnc(NC(N)=O)cc12)C(F)F |r|

BDBM633320

Cn1cc(-c2cccc(n2)C2COC2)c2cc(NC(N)=O)ncc12

BDBM633321

Cn1cc(-c2cccc(n2)C2(O)COC2)c2cc(NC(N)=O)ncc12

BDBM633322

COc1cc(nc(c1)C1(O)COC1)-c1cn(C)c2cnc(NC(C)=O)cc12

BDBM633323

CC(C)Oc1cc(nc(c1)C1(O)COC1)-c1cn(C)c2cnc(NC(C)=O)cc12

BDBM633324

CO[C@]1(CCOC1)c1cc(O[C@@H](C)CCO)cc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633325

CO[C@]1(CCOC1)c1cc(OC[C@H](C)O)cc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633326

CO[C@]1(CCOC1)c1cc(OC[C@@H](C)O)cc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633327

NC(=O)Nc1cc2c(cn([C@@H]3CCOC3)c2cn1)-c1cccc(n1)C1(O)COC1 |r|

BDBM633328

NC(=O)Nc1cc2c(cn([C@H]3CCOC3)c2cn1)-c1cccc(n1)C1(O)COC1 |r|

BDBM633329

CO[C@]1(CCOC1)c1cccc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633330

COC1(CCOC1)c1cccc(n1)-c1c[nH]c2cnc(NC(C)=O)cc12

BDBM633331

CO[C@@]1(CCOC1)c1cccc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633332

CO[C@]1(CCOC1)c1cccc(n1)-c1cn([C@H]2C[C@@H](C2)C#N)c2cnc(NC(C)=O)cc12 |r,wU:16.17,wD:2.1,18.22,(3.43,8.05,;3.03,6.56,;1.54,6.16,;.3,7.07,;-.95,6.16,;-.47,4.7,;1.07,4.7,;2.63,5.07,;4.12,5.47,;5.21,4.38,;4.81,2.9,;3.32,2.5,;2.23,3.59,;2.92,1.01,;3.83,-.24,;2.92,-1.48,;3.32,-2.97,;4.66,-3.74,;3.89,-5.07,;2.55,-4.3,;4.28,-6.56,;4.68,-8.05,;1.46,-1.01,;.13,-1.78,;-1.21,-1.01,;-1.21,.53,;-2.54,1.3,;-3.88,.53,;-5.21,1.3,;-3.88,-1.01,;.13,1.3,;1.46,.53,)|

BDBM633333

CO[C@]1(CCOC1)c1cccc(n1)-c1c[nH]c2cnc(NC(C)=O)cc12 |r|

BDBM633334

CO[C@]1(CCOC1)c1cccc(n1)-c1cn([C@@H]2C[C@@H](C2)C#N)c2cnc(NC(C)=O)cc12 |r,wU:16.17,18.22,wD:2.1,(3.43,8.05,;3.03,6.56,;1.54,6.16,;.3,7.07,;-.95,6.16,;-.47,4.7,;1.07,4.7,;2.63,5.07,;4.12,5.47,;5.21,4.38,;4.81,2.9,;3.32,2.5,;2.23,3.59,;2.92,1.01,;3.83,-.24,;2.92,-1.48,;3.32,-2.97,;2.55,-4.3,;3.89,-5.07,;4.66,-3.74,;4.28,-6.56,;4.68,-8.05,;1.46,-1.01,;.13,-1.78,;-1.21,-1.01,;-1.21,.53,;-2.54,1.3,;-3.88,.53,;-5.21,1.3,;-3.88,-1.01,;.13,1.3,;1.46,.53,)|

BDBM633335

CO[C@]1(CCOC1)c1cc(cc(n1)-c1cn([C@H]2C[C@@H](C2)C#N)c2cnc(NC(C)=O)cc12)C(F)F |r,wU:18.22,wD:2.1,16.17,(2.14,7.81,;1.74,6.32,;.26,5.92,;.73,7.39,;-.51,8.29,;-1.76,7.39,;-1.28,5.92,;1.34,4.83,;2.83,5.23,;3.92,4.14,;3.52,2.65,;2.03,2.26,;.95,3.34,;1.64,.77,;2.54,-.48,;1.64,-1.72,;2.03,-3.21,;1.26,-4.55,;2.6,-5.32,;3.37,-3.98,;3,-6.8,;3.4,-8.29,;.17,-1.25,;-1.16,-2.02,;-2.5,-1.25,;-2.5,.29,;-3.83,1.06,;-5.16,.29,;-6.5,1.06,;-5.16,-1.25,;-1.16,1.06,;.17,.29,;5.41,4.54,;6.5,3.45,;5.81,6.03,)|

BDBM633336

CO[C@]1(CCOC1)c1cc(cc(n1)-c1cn([C@@H]2C[C@@H](C2)C#N)c2cnc(NC(C)=O)cc12)C(F)F |r,wU:16.17,18.22,wD:2.1,(2.14,7.81,;1.74,6.32,;.26,5.92,;.73,7.39,;-.51,8.29,;-1.76,7.39,;-1.28,5.92,;1.34,4.83,;2.83,5.23,;3.92,4.14,;3.52,2.65,;2.03,2.26,;.95,3.34,;1.64,.77,;2.54,-.48,;1.64,-1.72,;2.03,-3.21,;1.26,-4.55,;2.6,-5.32,;3.37,-3.98,;3,-6.8,;3.4,-8.29,;.17,-1.25,;-1.16,-2.02,;-2.5,-1.25,;-2.5,.29,;-3.83,1.06,;-5.16,.29,;-6.5,1.06,;-5.16,-1.25,;-1.16,1.06,;.17,.29,;5.41,4.54,;6.5,3.45,;5.81,6.03,)|

BDBM633337

CO[C@]1(CCOC1)c1cc(C)cc(n1)-c1cn([C@H]2C[C@@H](C2)C#N)c2cnc(NC(C)=O)cc12 |r,wU:19.23,wD:2.1,17.18,(2.69,7.81,;2.29,6.32,;.8,5.92,;1.28,7.39,;.03,8.29,;-1.22,7.39,;-.74,5.92,;1.89,4.83,;3.38,5.23,;4.47,4.14,;5.95,4.54,;4.07,2.65,;2.58,2.26,;1.49,3.34,;2.18,.77,;3.09,-.48,;2.18,-1.72,;2.58,-3.21,;1.81,-4.55,;3.14,-5.32,;3.91,-3.98,;3.54,-6.8,;3.94,-8.29,;.72,-1.25,;-.62,-2.02,;-1.95,-1.25,;-1.95,.29,;-3.29,1.06,;-4.62,.29,;-5.95,1.06,;-4.62,-1.25,;-.62,1.06,;.72,.29,)|

BDBM633338

CO[C@]1(CCOC1)c1cc(C)cc(n1)-c1cn([C@@H]2C[C@@H](C2)C#N)c2cnc(NC(C)=O)cc12 |r,wU:17.18,19.23,wD:2.1,(2.69,7.81,;2.29,6.32,;.8,5.92,;1.28,7.39,;.03,8.29,;-1.22,7.39,;-.74,5.92,;1.89,4.83,;3.38,5.23,;4.47,4.14,;5.95,4.54,;4.07,2.65,;2.58,2.26,;1.49,3.34,;2.18,.77,;3.09,-.48,;2.18,-1.72,;2.58,-3.21,;1.81,-4.55,;3.14,-5.32,;3.91,-3.98,;3.54,-6.8,;3.94,-8.29,;.72,-1.25,;-.62,-2.02,;-1.95,-1.25,;-1.95,.29,;-3.29,1.06,;-4.62,.29,;-5.95,1.06,;-4.62,-1.25,;-.62,1.06,;.72,.29,)|

BDBM633339

CO[C@]1(CCOC1)c1cccc(n1)-c1cn(c2cnc(NC(C)=O)cc12)C1(C)COC1 |r|

BDBM633340

CO[C@]1(CCOC1)c1cccc(n1)-c1cn(c2cnc(NC(C)=O)cc12)C1(F)COC1 |r|

BDBM633341

CO[C@]1(CCOC1)c1cccc(n1)-c1cn(c2cnc(NC(N)=O)cc12)C1(C)COC1 |r|

BDBM633342

COc1cc(nc(c1)[C@@]1(CCOC1)OC)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633343

COc1cc(nc(c1)[C@]1(CCOC1)OC)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633344

CC(=O)Nc1cc2c(cn(C)c2cn1)-c1cccc(n1)[C@]1(CO)CCOC1 |r|

BDBM633345

CC(=O)Nc1cc2c(cn(C)c2cn1)-c1cccc(n1)[C@@]1(CO)CCOC1 |r|

BDBM633346

CC(=O)Nc1cc2c(c[nH]c2cn1)-c1cccc(n1)C1(CO)CCOC1

BDBM633347

COCc1cc(nc(c1)[C@]1(CO)CCOC1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633348

COCc1cc(nc(c1)[C@@]1(CO)CCOC1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633349

CO[C@]1(CCOC1)c1cc(OC(F)F)cc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633350

COCc1cc(nc(c1)[C@@]1(CCOC1)C(C)O)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633352

CC(=O)Nc1cc2c(cn(C)c2cn1)-c1cc(cc(n1)[C@]1(CO)CCOC1)C(F)F |r|

BDBM633353

COc1cc(nc(c1)[C@]1(CO)CCOC1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633354

COc1cc(nc(c1)[C@@]1(CO)CCOC1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633355

COCCOc1cc(nc(c1)[C@]1(CO)CCOC1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633356

COCCOc1cc(nc(c1)[C@@]1(CO)CCOC1)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633357

CO[C@H](C)COc1cc(nc(c1)[C@@]1(CCOC1)OC)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633358

COCc1cc(nc(c1)[C@@]1(CCOC1)OC)-c1nn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633359

COCc1cc(nc(c1)[C@@]1(CCOC1)OC)-c1cn(C)c2cnc(NC(=O)CO)cc12 |r|

BDBM633360

COCCOc1cc(nc(c1)[C@@]1(CCOC1)OC)-c1cn(C)c2cnc(NC(C)=O)cc12 |r|

BDBM633361

CO[C@]1(CCOC1)c1cc(cc(n1)-c1cn(C)c2cnc(NC(=O)CO)cc12)C(F)F |r|

BDBM643761

CN([C@@H]1CCc2cc(nn2C1)C#N)c1ncnc2[nH]ccc12 |r|

BDBM50602435

FC1(F)CC1C(=O)N1CC2(C1)CCC(CC2)c1cccc2nc(NC(=O)C3CC3)nn12

BDBM50602433

O=C(CC#N)N1CC2(C1)CCC(CC2)c1cccc2nc(NC(=O)C3CC3)nn12

BDBM50602441

CC(C)(C#N)C(=O)N1CC2(C1)CCC(CC2)c1cccc2nc(NC(=O)C3CC3)nn12

BDBM656600

FC1(F)C[C@H]1C(=O)N1CCC2(CC1)CCC(=CC2)c1cccc2nc(NC(=O)C3CC3)nn12 |r,c:17|

BDBM50602429

O=C(CC#N)N1CCC2(CCC(CC2)c2cccc3nc(NC(=O)C4CC4)nn23)CC1

BDBM50602430

FC(F)(F)CC(=O)N1CCC2(CCC(CC2)c2cccc3nc(NC(=O)C4CC4)nn23)CC1

BDBM656606

FC1(F)C[C@H]1C(=O)N1CC[C@@]2(C1)CCC(CC2)c1cccc2nc(NC(=O)C3CC3)nn12 |r,wU:10.10,wD:4.5,(4.45,19.53,;4.05,18.04,;5.38,18.81,;2.64,17.41,;3.89,16.51,;4.52,15.1,;6.05,14.94,;3.61,13.85,;2.07,13.85,;1.59,12.39,;2.84,11.48,;4.09,12.39,;4.17,10.71,;4.17,9.17,;2.84,8.4,;1.51,9.17,;1.51,10.71,;2.84,6.86,;4.17,6.09,;4.17,4.55,;2.84,3.78,;1.51,4.55,;.04,4.08,;-.86,5.32,;-2.4,5.32,;-3.17,3.99,;-2.4,2.66,;-4.71,3.99,;-6.05,4.76,;-6.05,3.22,;.04,6.57,;1.51,6.09,)|

BDBM656607

FC1(F)C[C@H]1C(=O)N1CC[C@@]2(C1)CCC(CC2)c1cccc2nc(NC(=O)C3CC3)nn12 |r,wD:10.10,4.5,(4.45,-2.66,;4.05,-4.14,;5.38,-3.37,;2.64,-4.77,;3.89,-5.68,;4.52,-7.08,;6.05,-7.24,;3.61,-8.33,;2.07,-8.33,;1.59,-9.79,;2.84,-10.7,;4.09,-9.79,;1.51,-11.47,;1.51,-13.01,;2.84,-13.78,;4.17,-13.01,;4.17,-11.47,;2.84,-15.32,;4.17,-16.09,;4.17,-17.63,;2.84,-18.4,;1.51,-17.63,;.04,-18.1,;-.86,-16.86,;-2.4,-16.86,;-3.17,-18.19,;-2.4,-19.53,;-4.71,-18.19,;-6.05,-17.42,;-6.05,-18.96,;.04,-15.61,;1.51,-16.09,)|

BDBM656609

FC(F)(F)CC(=O)N1CC[C@@]2(C1)CCC(CC2)c1cccc2nc(NC(=O)C3CC3)nn12 |r,wD:10.10,(6.78,-.71,;5.88,-1.96,;7.12,-2.86,;4.63,-1.05,;4.97,-3.2,;3.44,-3.04,;2.81,-1.64,;2.53,-4.29,;.99,-4.29,;.52,-5.75,;1.76,-6.66,;3.01,-5.75,;3.1,-7.43,;3.1,-8.97,;1.76,-9.74,;.43,-8.97,;.43,-7.43,;1.76,-11.28,;3.1,-12.05,;3.1,-13.59,;1.76,-14.36,;.43,-13.59,;-1.03,-14.07,;-1.94,-12.82,;-3.48,-12.82,;-4.25,-14.15,;-3.48,-15.49,;-5.79,-14.15,;-7.12,-13.38,;-7.12,-14.92,;-1.03,-11.57,;.43,-12.05,)|

BDBM656614

FC1(F)C[C@@H]1C(=O)Nc1nc2cccc(C3CCC4(CN(C4)C(=O)[C@@H]4CC4(F)F)CC3)n2n1 |r|

BDBM656618

FC1(F)C[C@H]1C(=O)Nc1nc2cccc(C3CCC4(CN(C4)C(=O)[C@@H]4CC4(F)F)CC3)n2n1 |r|

BDBM656620

FC1(F)CC1C(=O)Nc1nc2cccc(C3CCC4(CN(C4)C(=O)CC#N)CC3)n2n1

BDBM656622

Fc1ccc2nc(NC(=O)C3CC3)nn2c1C1CCC2(CC1)CCN(CC2)C(=O)CC#N

BDBM658846

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCNC1 |t:28|

BDBM658885

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCNCC1 |t:28|

BDBM658886

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCNCC1 |t:27|

BDBM658887

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCCNC1 |t:27|

BDBM658888

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCNC1 |t:27|

BDBM658889

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCCNC1 |t:28|

BDBM658890

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CC2COCC(C1)N2 |t:27|

BDBM658891

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=C[C@H](CO)NC1 |r,t:28|

BDBM658892

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=C[C@H](COC)NC1 |r,t:28|

BDBM658897

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CCCO)CC1 |t:28|

BDBM658898

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCN(CC1)C1CN(C)C1 |t:27|

BDBM658899

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CC1)C(=O)[C@@H]1CCCN1 |r,t:28|

BDBM658900

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCN(C[C@@H]2COCCN2)CC1 |r,t:27|

BDBM658901

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCNC1 |t:29|

BDBM658902

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCN(C)CC1 |t:27|

BDBM658903

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCN(CC1)C(C)C |t:27|

BDBM658904

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(C)CC1 |t:28|

BDBM658905

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CC1)C(C)C |t:28|

BDBM658906

CCN1CCC(=CC1)c1c[nH]c(n1)-c1n[nH]c2c(F)c(ccc12)-c1ccc(O)cc1CC |c:5|

BDBM658907

CCCN1CCC(=CC1)c1c[nH]c(n1)-c1n[nH]c2c(F)c(ccc12)-c1ccc(O)cc1CC |c:6|

BDBM658908

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CC(C)C)CC1 |t:28|

BDBM658909

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CC1)C1CCC1 |t:28|

BDBM658910

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCCN(C)C1 |t:27|

BDBM658912

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCCN(C)C1 |t:28|

BDBM658913

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCCN(C1)C(C)C |t:28|

BDBM658914

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(C)C1 |t:28|

BDBM658915

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(C1)C(C)C |t:28|

BDBM658916

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCN(CCO)CC1 |t:27|

BDBM658917

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCN(CCCO)CC1 |t:27|

BDBM658919

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CCO)CC1 |t:28|

BDBM658925

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCCN(CCCO)C1 |t:27|

BDBM658927

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCCN(CCO)C1 |t:28|

BDBM658928

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCCN(CCCO)C1 |t:28|

BDBM658933

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCN(CCO)C1 |t:27|

BDBM658936

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CCO)C1 |t:28|

BDBM658937

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CCCO)C1 |t:28|

BDBM658940

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCN(CC1)C1COC1 |t:27|

BDBM658947

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CC1)C1COC1 |t:28|

BDBM658952

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCCN(C1)C1CCOCC1 |t:28|

BDBM658953

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCCN(C1)C1COC1 |t:28|

BDBM658958

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(C1)C1COC1 |t:28|

BDBM658964

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CCSC)CC1 |t:28|

BDBM658973

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCCN(CCSC)C1 |t:28|

BDBM659005

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CC1)C1CCCCC1 |t:28|

BDBM659009

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCCN(C1)C1CCCCC1 |t:28|

BDBM659035

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCN(CC1)C(=O)CN |t:27|

BDBM659036

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCN(CC1)C(=O)[C@@H](N)C(C)(C)O |r,t:27|

BDBM659040

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CC1)C(=O)CN |t:28|

BDBM659041

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CC1)C(=O)[C@@H](N)C(C)(C)O |r,t:28|

BDBM659053

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCN(C1)C(=O)[C@@H](N)C(C)(C)O |r,t:27|

BDBM659056

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(C1)C(=O)CN |t:28|

BDBM659057

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(C1)C(=O)[C@@H](N)C(C)(C)O |r,t:28|

BDBM659058

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCN(CC1)S(=O)(=O)C1CNC1 |t:27|

BDBM659059

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCN(CC1)C(=O)[C@@H](N)Cc1ccccc1 |r,t:27|

BDBM659060

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCN(CC1)C(=O)[C@@H]1CCCN1 |r,t:27|

BDBM659061

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CC1)S(=O)(=O)C1CNC1 |t:28|

BDBM659062

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CC1)C(=O)[C@@H](N)Cc1ccccc1 |r,t:28|

BDBM659063

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(C1)S(=O)(=O)C1CNC1 |t:28|

BDBM659064

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(C1)C(=O)[C@@H]1CCCN1 |r,t:28|

BDBM659065

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCN(CC1)C1CCN(C)CC1 |t:27|

BDBM659066

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCN(CCNC)CC1 |t:27|

BDBM659067

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCN(CCN2CCOCC2)CC1 |t:27|

BDBM659068

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CC1)C1CCN(C)CC1 |t:28|

BDBM659069

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CC1)C1CN(C)C1 |t:28|

BDBM659070

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CCN)CC1 |t:28|

BDBM659071

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CCNC)CC1 |t:28|

BDBM659072

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(C[C@@H]2COCCN2)CC1 |r,t:28|

BDBM659074

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CCN2CCOCC2)CC1 |t:28|

BDBM659075

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCCN(C1)C1CCN(C)CC1 |t:27|

BDBM659076

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCCN(C[C@@H]2COCCN2)C1 |r,t:27|

BDBM659077

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCCN(C1)C1CCN(C)CC1 |t:28|

BDBM659078

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCCN(C1)C1CN(C)C1 |t:28|

BDBM659079

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCCN(C[C@@H]2COCCN2)C1 |r,t:28|

BDBM659080

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCCN(C[C@H]2COCCN2)C1 |r,t:28|

BDBM659081

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCCN(CCN2CCOCC2)C1 |t:28|

BDBM659082

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCN(C1)C1CCN(C)CC1 |t:27|

BDBM659084

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(C1)C1CCN(C)CC1 |t:28|

BDBM659085

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(C1)C1CN(C)C1 |t:28|

BDBM659086

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CCN)C1 |t:28|

BDBM659087

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CCNC)C1 |t:28|

BDBM659088

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(C[C@@H]2COCCN2)C1 |r,t:28|

BDBM659089

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CCN2CCOCC2)C1 |t:28|

BDBM659090

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CC1)C1CCNC1 |t:28|

BDBM659091

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CC1)C1CCN(C)C1 |t:28|

BDBM659092

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CCN(C)C)CC1 |t:28|

BDBM659093

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(C[C@@H]2COCCN2C)CC1 |r,t:28|

BDBM659094

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CC1)C1CCCNC1 |t:28|

BDBM659095

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CC1)C1CCCN(C)C1 |t:28|

BDBM659096

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CC1)C(C)CN |t:28|

BDBM659097

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCCN(C1)C1CCNC1 |t:28|

BDBM659098

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCCN(C1)C1CCN(C)C1 |t:28|

BDBM659099

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCCN(C1)C1CCCNC1 |t:28|

BDBM659100

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCCN(C1)C1CCCN(C)C1 |t:28|

BDBM659101

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(C1)C1CCNC1 |t:28|

BDBM659102

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(C1)C1CCN(C)C1 |t:28|

BDBM659103

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(CCN(C)C)C1 |t:28|

BDBM659104

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(C[C@@H]2COCCN2C)C1 |r,t:28|

BDBM659105

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(C1)C1CCCNC1 |t:28|

BDBM659106

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(C1)C1CCCN(C)C1 |t:28|

BDBM659107

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=C(C)CNCC1 |c:27|

BDBM659108

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CC2CCCC(C1)N2 |t:27|

BDBM659109

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CC(C)(C)NC(C)(C)C1 |t:27|

BDBM659110

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=C(C)CNCC1 |c:28|

BDBM659113

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CC[C@H](C)NC1 |r,t:27|

BDBM659114

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CC[C@@H](C)NC1 |r,t:27|

BDBM659117

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CC[C@H](C)NC1 |r,t:28|

BDBM659118

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CC[C@@H](C)NC1 |r,t:28|

BDBM659121

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CC(C)NC1 |t:27|

BDBM659127

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CC(C)NC1 |t:28|

BDBM659128

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=C[C@@H](CO)NC1 |r,t:28|

BDBM659129

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=C[C@@H](COC)NC1 |r,t:28|

BDBM659164

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=C[C@@H](CO)N(CCS(=O)(=O)NC)C1 |r,t:28|

BDBM659165

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=C[C@@H](CO)N(CCS(=O)(=O)N(C)C)C1 |r,t:28|

BDBM659174

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c(C)[nH]1)C1=CCNCC1 |t:28|

BDBM659176

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=C(C)CNC1 |c:28|

BDBM659181

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCNCC1C |t:27|

BDBM659182

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=C[C@H](C)NCC1 |r,t:28|

BDBM659183

CCOC(=O)C1CC=C(CN1)c1c[nH]c(n1)-c1n[nH]c2c(F)c(ccc12)-c1ccc(O)cc1CC |c:7|

BDBM659188

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(C1)[C@@H]1CC[C@H](O)CC1 |r,wU:29.33,32.37,t:28,(-1.63,.04,;-2.96,.82,;-4.3,.05,;-5.63,.83,;-6.96,.06,;-8.3,.83,;-6.97,-1.48,;-5.64,-2.25,;-4.3,-1.49,;-2.97,-2.26,;-1.63,-1.5,;-.3,-2.27,;-.31,-3.81,;.83,-4.84,;.2,-6.25,;-1.33,-6.08,;-1.64,-4.58,;-2.98,-3.8,;-4.31,-4.57,;2.34,-4.53,;2.97,-3.12,;4.5,-3.29,;4.82,-4.8,;3.48,-5.56,;5.54,-2.15,;7.07,-2.31,;7.7,-.91,;6.56,.13,;5.22,-.64,;6.72,1.66,;8.13,2.28,;8.3,3.81,;7.05,4.72,;7.22,6.25,;5.64,4.1,;5.48,2.57,)|

BDBM659190

CCOC[C@@H]1NCC(=C1)c1c[nH]c(n1)-c1n[nH]c2c(F)c(ccc12)-c1ccc(O)cc1CC |r,c:7|

BDBM659204

CCC1NCC(=C1)c1c[nH]c(n1)-c1n[nH]c2c(F)c(ccc12)-c1ccc(O)cc1CC |c:5|

BDBM659266

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc(c[nH]1)C1=CCN(C[C@@H]2COCCN2C(=O)OC(C)(C)C)CC1 |r,t:27|

BDBM659273

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1F)-c1nc(c[nH]1)C1=CCN(C[C@@H]2CCN2)CC1 |r,t:28|

BDBM661248

CCONC(=O)c1cnc(Nc2cc(C)nc(C)n2)cc1Nc1ccc(cc1N(C)S(C)(=O)=O)C1CC1

BDBM661249

CCONC(=O)c1cnc(Nc2cc(C)nc(C)n2)cc1Nc1cc(F)c(cc1N(C)S(C)(=O)=O)C1CC1

BDBM661946

CCONC(=O)c1cnc(Nc2cc(C)nc(C)n2)cc1Nc1ccc(Cl)cc1N(C)S(C)(=O)=O

BDBM661256

CCONC(=O)c1cnc(Nc2cc(C)nc(C)n2)cc1Nc1ccc(OCC)cc1N(C)S(C)(=O)=O

BDBM661257

CCONC(=O)c1cnc(Nc2cc(C)nc(C)n2)cc1Nc1ccc(C)nc1N(C)S(C)(=O)=O

BDBM661258

CCONC(=O)c1cnc(Nc2ccnc(C)n2)cc1Nc1ccc(cc1N(C)S(C)(=O)=O)C1CC1

BDBM661947

CCONC(=O)c1cnc(Nc2cc(C)nc(C)n2)cc1Nc1cc(F)c(CC)cc1N(C)S(C)(=O)=O

BDBM661259

CCONC(=O)c1cnc(Nc2ccnc(C)n2)cc1Nc1cc(F)c(cc1N(C)S(C)(=O)=O)C1CC1

BDBM661260

CCONC(=O)c1cnc(Nc2cc(C)nc(C)n2)cc1Nc1cc(F)c(Cl)cc1N(C)S(C)(=O)=O

BDBM661261

CCONC(=O)c1cnc(Nc2ccnc(OC)n2)cc1Nc1cc(F)c(Cl)cc1N(C)S(C)(=O)=O

BDBM661948

CCONC(=O)c1cnc(Nc2cc(C)nc(C)n2)cc1Nc1ccc(cc1N(C)S(C)(=O)=O)C(C)C

BDBM661262

CCONC(=O)c1cnc(Nc2cc(C)nc(C)n2)cc1Nc1ccc(cc1N(C)S(C)(=O)=O)C(F)(F)F

BDBM661263

CCONC(=O)c1cnc(Nc2cc(C)nc(C)n2)cc1Nc1cc(F)cc(-c2ncn(n2)C2CC2)c1OC

BDBM661264

CCONC(=O)c1cnc(Nc2cc(C)nc(C)n2)cc1Nc1cccc(-c2ncccn2)c1OC

BDBM661949

CCONC(=O)c1cnc(Nc2cc(C)nc(C)n2)cc1Nc1cc(F)cc(-c2cnc(C)cn2)c1OC

BDBM661265

CCONC(=O)c1cnc(Nc2cc(C)nc(C)n2)cc1Nc1cc(F)cc(-c2ncccn2)c1OC

BDBM661266

CCONC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ncc(Cl)cn2)c1OC

BDBM661267

CCONC(=O)c1cnc(Nc2cc(C)nc(C)n2)cc1Nc1cc(F)c(cc1N(C)S(C)(=O)=O)C(C)C

BDBM661950

CCONC(=O)c1cnc(NC(=O)C2CC2(F)F)cc1Nc1ccc(cc1N(C)S(C)(=O)=O)C1CC1 |w:11.12|

BDBM686568

CNC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)NCc2ccc(NC(=O)C=C)cn2)c1OC

BDBM686581

CNC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)NCc2ccc(NC(=O)CCl)cn2)c1OC

BDBM686592

CNC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cccc(-c2cc(=O)n(cn2)C2CC2)c1OC

BDBM686602

CNC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2cc(=O)n(cn2)C2CC2)c1OC

BDBM686610

CNC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(c1OC)-n1cnc(C)n1

BDBM686626

CNC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cc(F)cc(-c2cc(=O)n(cn2)C2CC2)c1OC

BDBM686663

CNC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2nc(=O)n(C)[nH]2)c1OC

BDBM687760

Fc1cccc(F)c1-c1nc(Nc2ccc(cc2)C(=O)N2CCOCC2)c2n1cc[nH]c2=O |(-5.03,3.44,;-3.52,3.76,;-3.05,5.23,;-1.54,5.55,;-.51,4.4,;-.99,2.94,;.04,1.79,;-2.49,2.62,;-2.97,1.15,;-2.06,-.09,;-2.97,-1.34,;-2.49,-2.8,;-.99,-3.12,;-.51,-4.59,;1,-4.91,;2.03,-3.76,;1.55,-2.3,;.04,-1.98,;3.53,-4.08,;4.01,-5.55,;4.56,-2.94,;6.07,-3.26,;7.1,-2.11,;6.62,-.65,;5.12,-.33,;4.09,-1.47,;-4.43,-.86,;-4.43,.68,;-5.77,1.45,;-7.1,.68,;-7.1,-.86,;-5.77,-1.63,;-5.77,-3.17,)|

BDBM687777

Fc1cccc(F)c1-c1nc(Nc2ccc(cc2)C(=O)N2CCOCC2)c2C(=O)NCCn12 |(-5.03,3.44,;-3.52,3.76,;-3.05,5.23,;-1.54,5.55,;-.51,4.4,;-.99,2.94,;.04,1.79,;-2.49,2.62,;-2.97,1.15,;-2.06,-.09,;-2.97,-1.34,;-2.49,-2.8,;-.99,-3.12,;-.51,-4.59,;1,-4.91,;2.03,-3.76,;1.55,-2.3,;.04,-1.98,;3.53,-4.08,;4.01,-5.55,;4.56,-2.94,;6.07,-3.26,;7.1,-2.11,;6.62,-.65,;5.12,-.33,;4.09,-1.47,;-4.43,-.86,;-5.77,-1.63,;-5.77,-3.17,;-7.1,-.86,;-7.1,.68,;-5.77,1.45,;-4.43,.68,)|

BDBM687790

Fc1cccc(Cl)c1-c1nc(Nc2ccc(cc2)C(=O)N2CCOCC2)c2n1cc[nH]c2=O |(-5.03,3.44,;-3.52,3.76,;-3.05,5.23,;-1.54,5.55,;-.51,4.4,;-.99,2.94,;.04,1.79,;-2.49,2.62,;-2.97,1.15,;-2.06,-.09,;-2.97,-1.34,;-2.49,-2.8,;-.99,-3.12,;-.51,-4.59,;1,-4.91,;2.03,-3.76,;1.55,-2.3,;.04,-1.98,;3.53,-4.08,;4.01,-5.55,;4.56,-2.94,;6.07,-3.26,;7.1,-2.11,;6.62,-.65,;5.12,-.33,;4.09,-1.47,;-4.43,-.86,;-4.43,.68,;-5.77,1.45,;-7.1,.68,;-7.1,-.86,;-5.77,-1.63,;-5.77,-3.17,)|

BDBM687804

Cn1cc(Nc2nc(-c3c(F)cccc3F)n3cc[nH]c(=O)c23)cn1 |(5,-2.74,;3.59,-3.37,;2.26,-2.6,;1.11,-3.63,;-.39,-3.31,;-.87,-1.85,;.04,-.6,;-.87,.64,;-.39,2.11,;-1.42,3.25,;-2.93,2.93,;-.95,4.72,;.56,5.04,;1.59,3.89,;1.11,2.43,;2.14,1.29,;-2.33,.17,;-3.67,.94,;-5,.17,;-5,-1.37,;-3.67,-2.14,;-3.67,-3.68,;-2.33,-1.37,;1.74,-5.04,;3.27,-4.88,)|

BDBM687839

Cn1cc(Nc2nc(-c3c(F)cccc3F)n3CCNC(=O)c23)cn1 |(5,-2.74,;3.59,-3.37,;2.26,-2.6,;1.11,-3.63,;-.39,-3.31,;-.87,-1.85,;.04,-.6,;-.87,.64,;-.39,2.11,;-1.42,3.25,;-2.93,2.93,;-.95,4.72,;.56,5.04,;1.59,3.89,;1.11,2.43,;2.14,1.29,;-2.33,.17,;-3.67,.94,;-5,.17,;-5,-1.37,;-3.67,-2.14,;-3.67,-3.68,;-2.33,-1.37,;1.74,-5.04,;3.27,-4.88,)|

BDBM687859

Fc1cccc(F)c1-c1nc(Nc2ccc(cc2)N2CCOCC2)c2n1cc[nH]c2=O |(-4.75,3.6,;-3.25,3.92,;-2.77,5.39,;-1.26,5.71,;-.23,4.56,;-.71,3.1,;.32,1.95,;-2.22,2.78,;-2.69,1.31,;-1.79,.07,;-2.69,-1.18,;-2.22,-2.64,;-.71,-2.96,;-.23,-4.43,;1.27,-4.75,;2.3,-3.6,;1.83,-2.14,;.32,-1.82,;3.81,-3.92,;4.29,-5.39,;5.79,-5.71,;6.82,-4.56,;6.35,-3.1,;4.84,-2.78,;-4.16,-.7,;-4.16,.84,;-5.49,1.61,;-6.82,.84,;-6.82,-.7,;-5.49,-1.47,;-5.49,-3.01,)|

BDBM687860

Cn1ccc(Nc2nc(-c3c(F)cccc3F)n3cc[nH]c(=O)c23)n1 |(5,-2.74,;3.59,-3.37,;3.27,-4.88,;1.74,-5.04,;1.11,-3.63,;-.39,-3.31,;-.87,-1.85,;.04,-.6,;-.87,.64,;-.39,2.11,;-1.42,3.25,;-2.93,2.93,;-.95,4.72,;.56,5.04,;1.59,3.89,;1.11,2.43,;2.14,1.29,;-2.33,.17,;-3.67,.94,;-5,.17,;-5,-1.37,;-3.67,-2.14,;-3.67,-3.68,;-2.33,-1.37,;2.26,-2.6,)|

BDBM687861

Cn1ccc(Nc2nc(-c3c(F)cccc3F)n3CCNC(=O)c23)n1 |(5,-2.74,;3.59,-3.37,;3.27,-4.88,;1.74,-5.04,;1.11,-3.63,;-.39,-3.31,;-.87,-1.85,;.04,-.6,;-.87,.64,;-.39,2.11,;-1.42,3.25,;-2.93,2.93,;-.95,4.72,;.56,5.04,;1.59,3.89,;1.11,2.43,;2.14,1.29,;-2.33,.17,;-3.67,.94,;-5,.17,;-5,-1.37,;-3.67,-2.14,;-3.67,-3.68,;-2.33,-1.37,;2.26,-2.6,)|

BDBM687862

Fc1cccc(F)c1-c1nc(Nc2ccc(cn2)N2CCOCC2)c2n1cc[nH]c2=O |(-4.75,3.6,;-3.25,3.92,;-2.77,5.39,;-1.26,5.71,;-.23,4.56,;-.71,3.1,;.32,1.95,;-2.22,2.78,;-2.69,1.31,;-1.79,.07,;-2.69,-1.18,;-2.22,-2.64,;-.71,-2.96,;-.23,-4.43,;1.27,-4.75,;2.3,-3.6,;1.83,-2.14,;.32,-1.82,;3.81,-3.92,;4.29,-5.39,;5.79,-5.71,;6.82,-4.56,;6.35,-3.1,;4.84,-2.78,;-4.16,-.7,;-4.16,.84,;-5.49,1.61,;-6.82,.84,;-6.82,-.7,;-5.49,-1.47,;-5.49,-3.01,)|

BDBM687863

Fc1cccc(F)c1-c1nc(Nc2ccc(cc2)N2CCOCC2)c2C(=O)NCCn12 |(-4.75,3.6,;-3.25,3.92,;-2.77,5.39,;-1.26,5.71,;-.23,4.56,;-.71,3.1,;.32,1.95,;-2.22,2.78,;-2.69,1.31,;-1.79,.07,;-2.69,-1.18,;-2.22,-2.64,;-.71,-2.96,;-.23,-4.43,;1.27,-4.75,;2.3,-3.6,;1.83,-2.14,;.32,-1.82,;3.81,-3.92,;4.29,-5.39,;5.79,-5.71,;6.82,-4.56,;6.35,-3.1,;4.84,-2.78,;-4.16,-.7,;-5.49,-1.47,;-5.49,-3.01,;-6.82,-.7,;-6.82,.84,;-5.49,1.61,;-4.16,.84,)|

BDBM687864

CS(=O)(=O)c1ccc(Nc2nc(-c3c(F)cccc3F)n3cc[nH]c(=O)c23)cc1 |(5.68,-2.93,;4.65,-4.07,;5.98,-4.84,;4.25,-5.56,;3.14,-3.75,;2.11,-4.9,;.61,-4.58,;.13,-3.11,;-1.38,-2.79,;-1.85,-1.33,;-.95,-.08,;-1.85,1.17,;-1.38,2.63,;-2.41,3.77,;-3.91,3.45,;-1.93,5.24,;-.42,5.56,;.61,4.41,;.13,2.95,;1.16,1.81,;-3.32,.69,;-4.65,1.46,;-5.98,.69,;-5.98,-.85,;-4.65,-1.62,;-4.65,-3.16,;-3.32,-.85,;1.16,-1.97,;2.67,-2.29,)|

BDBM687865

CS(=O)(=O)c1ccc(Nc2nc(-c3c(F)cccc3F)n3CCNC(=O)c23)cc1 |(5.68,-2.93,;4.65,-4.07,;5.98,-4.84,;4.25,-5.56,;3.14,-3.75,;2.11,-4.9,;.61,-4.58,;.13,-3.11,;-1.38,-2.79,;-1.85,-1.33,;-.95,-.08,;-1.85,1.17,;-1.38,2.63,;-2.41,3.77,;-3.91,3.45,;-1.93,5.24,;-.42,5.56,;.61,4.41,;.13,2.95,;1.16,1.81,;-3.32,.69,;-4.65,1.46,;-5.98,.69,;-5.98,-.85,;-4.65,-1.62,;-4.65,-3.16,;-3.32,-.85,;1.16,-1.97,;2.67,-2.29,)|

BDBM687866

CC(C)(C(=O)N1CCC1)c1ccc(Nc2nc(-c3c(F)cccc3F)n3CCNC(=O)c23)cc1 |(4.32,-4.84,;2.98,-4.07,;2.58,-5.56,;4.01,-2.93,;3.54,-1.46,;5.52,-3.25,;6.36,-4.54,;7.65,-3.7,;6.81,-2.41,;1.48,-3.75,;.45,-4.9,;-1.06,-4.58,;-1.54,-3.11,;-3.04,-2.79,;-3.52,-1.33,;-2.61,-.08,;-3.52,1.17,;-3.04,2.63,;-4.07,3.77,;-5.58,3.45,;-3.6,5.24,;-2.09,5.56,;-1.06,4.41,;-1.54,2.95,;-.51,1.81,;-4.98,.69,;-6.32,1.46,;-7.65,.69,;-7.65,-.85,;-6.32,-1.62,;-6.32,-3.16,;-4.98,-.85,;-.51,-1.97,;1,-2.29,)|

BDBM687867

Fc1cccc(F)c1-c1nc(Nc2ccc(CC(=O)N3CCOCC3)cc2)c2n1cc[nH]c2=O |(-6.02,3.19,;-4.51,3.51,;-4.04,4.98,;-2.53,5.3,;-1.5,4.15,;-1.98,2.69,;-.95,1.54,;-3.48,2.37,;-3.96,.9,;-3.05,-.34,;-3.96,-1.59,;-3.48,-3.05,;-1.98,-3.37,;-1.5,-4.84,;.01,-5.16,;1.04,-4.02,;2.54,-4.34,;3.57,-3.19,;3.1,-1.73,;5.08,-3.51,;5.55,-4.98,;7.06,-5.3,;8.09,-4.15,;7.62,-2.69,;6.11,-2.37,;.56,-2.55,;-.95,-2.23,;-5.42,-1.11,;-5.42,.43,;-6.76,1.2,;-8.09,.43,;-8.09,-1.11,;-6.76,-1.88,;-6.76,-3.42,)|

BDBM687869

Fc1cccc(F)c1-c1nc(Nc2ccc(CC(=O)N3CCOCC3)cc2)c2C(=O)NCCn12 |(-6.02,3.19,;-4.51,3.51,;-4.04,4.98,;-2.53,5.3,;-1.5,4.15,;-1.98,2.69,;-.95,1.54,;-3.48,2.37,;-3.96,.9,;-3.05,-.34,;-3.96,-1.59,;-3.48,-3.05,;-1.98,-3.37,;-1.5,-4.84,;.01,-5.16,;1.04,-4.02,;2.54,-4.34,;3.57,-3.19,;3.1,-1.73,;5.08,-3.51,;5.55,-4.98,;7.06,-5.3,;8.09,-4.15,;7.62,-2.69,;6.11,-2.37,;.56,-2.55,;-.95,-2.23,;-5.42,-1.11,;-6.76,-1.88,;-6.76,-3.42,;-8.09,-1.11,;-8.09,.43,;-6.76,1.2,;-5.42,.43,)|

BDBM687870

CC(C)(C(=O)N1CCOCC1)c1ccc(Nc2nc(-c3c(F)cccc3F)n3cc[nH]c(=O)c23)cc1 |(2.14,-5.56,;2.54,-4.07,;3.63,-5.16,;3.57,-2.93,;3.1,-1.46,;5.08,-3.25,;5.55,-4.71,;7.06,-5.03,;8.09,-3.89,;7.62,-2.42,;6.11,-2.1,;1.04,-3.75,;.01,-4.9,;-1.5,-4.58,;-1.98,-3.11,;-3.48,-2.79,;-3.96,-1.33,;-3.05,-.08,;-3.96,1.17,;-3.48,2.63,;-4.51,3.77,;-6.02,3.45,;-4.04,5.24,;-2.53,5.56,;-1.5,4.41,;-1.98,2.95,;-.95,1.81,;-5.42,.69,;-6.76,1.46,;-8.09,.69,;-8.09,-.85,;-6.76,-1.62,;-6.76,-3.16,;-5.42,-.85,;-.95,-1.97,;.56,-2.29,)|

BDBM687871

CC(C)(C(=O)N1CCOCC1)c1ccc(Nc2nc(-c3c(F)cccc3F)n3CCNC(=O)c23)cc1 |(2.14,-5.56,;2.54,-4.07,;3.63,-5.16,;3.57,-2.93,;3.1,-1.46,;5.08,-3.25,;5.55,-4.71,;7.06,-5.03,;8.09,-3.89,;7.62,-2.42,;6.11,-2.1,;1.04,-3.75,;.01,-4.9,;-1.5,-4.58,;-1.98,-3.11,;-3.48,-2.79,;-3.96,-1.33,;-3.05,-.08,;-3.96,1.17,;-3.48,2.63,;-4.51,3.77,;-6.02,3.45,;-4.04,5.24,;-2.53,5.56,;-1.5,4.41,;-1.98,2.95,;-.95,1.81,;-5.42,.69,;-6.76,1.46,;-8.09,.69,;-8.09,-.85,;-6.76,-1.62,;-6.76,-3.16,;-5.42,-.85,;-.95,-1.97,;.56,-2.29,)|

BDBM687872

CC(=O)N1CCC(CC1)c1nc(Nc2ccc(cc2)C(=O)N2CCOCC2)c2n1cc[nH]c2=O

BDBM687873

O=C(N1CCOCC1)c1ccc(Nc2nc(C3CCNCC3)n3cc[nH]c(=O)c23)cc1

BDBM687874

O=C(N1CCOCC1)c1ccc(Nc2nc(C3CCN(CC3)C3CC3)n3cc[nH]c(=O)c23)cc1

BDBM687875

Fc1cccc(F)c1-c1nc(Nc2cccc(c2)C(=O)N2CCOCC2)c2n1cc[nH]c2=O |(-5.12,3.08,;-3.63,3.48,;-3.23,4.96,;-1.75,5.36,;-.66,4.27,;-1.06,2.79,;.03,1.7,;-2.54,2.39,;-2.94,.9,;-2.04,-.35,;-2.94,-1.59,;-2.54,-3.08,;-1.06,-3.48,;-.66,-4.96,;.83,-5.36,;1.92,-4.27,;1.52,-2.79,;.03,-2.39,;2.61,-1.7,;2.21,-.21,;4.1,-2.1,;4.5,-3.58,;5.98,-3.98,;7.07,-2.89,;6.67,-1.41,;5.19,-1.01,;-4.41,-1.12,;-4.41,.42,;-5.74,1.19,;-7.07,.42,;-7.07,-1.12,;-5.74,-1.89,;-5.74,-3.43,)|

BDBM687876

Fc1cccc(F)c1-c1nc(Nc2cccc(c2)C(=O)N2CCOCC2)c2C(=O)NCCn12 |(-5.12,3.08,;-3.63,3.48,;-3.23,4.96,;-1.75,5.36,;-.66,4.27,;-1.06,2.79,;.03,1.7,;-2.54,2.39,;-2.94,.9,;-2.04,-.35,;-2.94,-1.59,;-2.54,-3.08,;-1.06,-3.48,;-.66,-4.96,;.83,-5.36,;1.92,-4.27,;1.52,-2.79,;.03,-2.39,;2.61,-1.7,;2.21,-.21,;4.1,-2.1,;4.5,-3.58,;5.98,-3.98,;7.07,-2.89,;6.67,-1.41,;5.19,-1.01,;-4.41,-1.12,;-5.74,-1.89,;-5.74,-3.43,;-7.07,-1.12,;-7.07,.42,;-5.74,1.19,;-4.41,.42,)|

BDBM687877

Fc1cccc(F)c1-c1nc(Nc2cnn(CC(=O)N3CCOCC3)c2)c2C(=O)NCCn12 |(-5.82,3.13,;-4.33,3.52,;-3.93,5.01,;-2.44,5.41,;-1.35,4.32,;-1.75,2.83,;-.66,1.74,;-3.24,2.44,;-3.64,.95,;-2.73,-.3,;-3.64,-1.54,;-3.24,-3.03,;-1.75,-3.43,;-1.16,-4.85,;.37,-4.73,;.73,-3.23,;2.22,-2.83,;3.31,-3.92,;2.91,-5.41,;4.8,-3.52,;5.88,-4.61,;7.37,-4.21,;7.77,-2.73,;6.68,-1.64,;5.19,-2.04,;-.58,-2.43,;-5.1,-1.07,;-6.44,-1.84,;-6.44,-3.38,;-7.77,-1.07,;-7.77,.47,;-6.44,1.24,;-5.1,.47,)|

BDBM687878

CN1CCN(CC1)C(=O)Cn1cc(Nc2nc(-c3c(F)cccc3F)n3CCNC(=O)c23)cn1 |(8.51,-2.33,;7.03,-2.73,;6.63,-4.21,;5.14,-4.61,;4.05,-3.52,;4.45,-2.04,;5.94,-1.64,;2.56,-3.92,;2.17,-5.41,;1.48,-2.83,;-.01,-3.23,;-1.33,-2.43,;-2.5,-3.43,;-3.98,-3.03,;-4.38,-1.54,;-3.48,-.3,;-4.38,.95,;-3.98,2.44,;-5.07,3.52,;-6.56,3.13,;-4.67,5.01,;-3.19,5.41,;-2.1,4.32,;-2.5,2.83,;-1.41,1.74,;-5.85,.47,;-7.18,1.24,;-8.51,.47,;-8.51,-1.07,;-7.18,-1.84,;-7.18,-3.38,;-5.85,-1.07,;-1.91,-4.85,;-.37,-4.73,)|

BDBM687879

Cn1cc(Nc2nc(-c3c(F)cccc3Cl)n3cc[nH]c(=O)c23)cn1 |(4.99,-3.11,;3.51,-3.51,;2.19,-2.71,;1.02,-3.71,;-.46,-3.31,;-.86,-1.82,;.04,-.58,;-.86,.67,;-.46,2.16,;-1.55,3.25,;-3.04,2.85,;-1.15,4.73,;.33,5.13,;1.42,4.04,;1.02,2.55,;2.11,1.47,;-2.33,.19,;-3.66,.96,;-4.99,.19,;-4.99,-1.35,;-3.66,-2.12,;-3.66,-3.66,;-2.33,-1.35,;1.61,-5.13,;3.15,-5.01,)|

BDBM687880

NC(=O)c1ccc(Nc2nc(-c3c(F)cccc3F)n3cc[nH]c(=O)c23)cc1 |(5.78,-3.19,;4.7,-4.27,;5.09,-5.76,;3.21,-3.88,;2.12,-4.96,;.63,-4.57,;.23,-3.08,;-1.25,-2.68,;-1.65,-1.19,;-.75,.05,;-1.65,1.3,;-1.25,2.79,;-2.34,3.88,;-3.83,3.48,;-1.94,5.36,;-.46,5.76,;.63,4.67,;.23,3.19,;1.32,2.1,;-3.12,.82,;-4.45,1.59,;-5.78,.82,;-5.78,-.72,;-4.45,-1.49,;-4.45,-3.03,;-3.12,-.72,;1.32,-1.99,;2.81,-2.39,)|

BDBM687881

NC(=O)c1ccc(Nc2nc(-c3c(F)cccc3Cl)n3cc[nH]c(=O)c23)cc1 |(5.78,-3.19,;4.7,-4.27,;5.09,-5.76,;3.21,-3.88,;2.12,-4.96,;.63,-4.57,;.23,-3.08,;-1.25,-2.68,;-1.65,-1.19,;-.75,.05,;-1.65,1.3,;-1.25,2.79,;-2.34,3.88,;-3.83,3.48,;-1.94,5.36,;-.46,5.76,;.63,4.67,;.23,3.19,;1.32,2.1,;-3.12,.82,;-4.45,1.59,;-5.78,.82,;-5.78,-.72,;-4.45,-1.49,;-4.45,-3.03,;-3.12,-.72,;1.32,-1.99,;2.81,-2.39,)|

BDBM687882

CN1CCN(CC1)C(=O)c1ccc(Nc2nc(-c3c(F)cccc3F)n3cc[nH]c(=O)c23)cc1 |(7.42,.08,;6.33,-1.01,;6.73,-2.49,;5.64,-3.58,;4.15,-3.19,;3.75,-1.7,;4.84,-.61,;3.06,-4.27,;3.46,-5.76,;1.57,-3.88,;.49,-4.96,;-1,-4.57,;-1.4,-3.08,;-2.89,-2.68,;-3.29,-1.19,;-2.38,.05,;-3.29,1.3,;-2.89,2.79,;-3.98,3.88,;-5.46,3.48,;-3.58,5.36,;-2.09,5.76,;-1,4.67,;-1.4,3.19,;-.31,2.1,;-4.75,.82,;-6.08,1.59,;-7.42,.82,;-7.42,-.72,;-6.08,-1.49,;-6.08,-3.03,;-4.75,-.72,;-.31,-1.99,;1.18,-2.39,)|

BDBM687883

Fc1cccc(F)c1-c1nc(Nc2ccc(cc2)C(=O)N2CCNCC2)c2n1cc[nH]c2=O |(-5.12,3.48,;-3.63,3.88,;-3.23,5.36,;-1.75,5.76,;-.66,4.67,;-1.06,3.19,;.03,2.1,;-2.54,2.79,;-2.94,1.3,;-2.04,.05,;-2.94,-1.19,;-2.54,-2.68,;-1.06,-3.08,;-.66,-4.57,;.83,-4.96,;1.92,-3.88,;1.52,-2.39,;.03,-1.99,;3.41,-4.27,;3.81,-5.76,;4.5,-3.19,;5.98,-3.58,;7.07,-2.49,;6.67,-1.01,;5.19,-.61,;4.1,-1.7,;-4.41,-.72,;-4.41,.82,;-5.74,1.59,;-7.07,.82,;-7.07,-.72,;-5.74,-1.49,;-5.74,-3.03,)|

BDBM687884

CN1CCN(CC1)C(=O)c1ccc(Nc2nc(-c3c(F)cccc3Cl)n3cc[nH]c(=O)c23)cc1 |(7.42,.08,;6.33,-1.01,;6.73,-2.49,;5.64,-3.58,;4.15,-3.19,;3.75,-1.7,;4.84,-.61,;3.06,-4.27,;3.46,-5.76,;1.57,-3.88,;.49,-4.96,;-1,-4.57,;-1.4,-3.08,;-2.89,-2.68,;-3.29,-1.19,;-2.38,.05,;-3.29,1.3,;-2.89,2.79,;-3.98,3.88,;-5.46,3.48,;-3.58,5.36,;-2.09,5.76,;-1,4.67,;-1.4,3.19,;-.31,2.1,;-4.75,.82,;-6.08,1.59,;-7.42,.82,;-7.42,-.72,;-6.08,-1.49,;-6.08,-3.03,;-4.75,-.72,;-.31,-1.99,;1.18,-2.39,)|

BDBM687885

Fc1cccc(Cl)c1-c1nc(Nc2ccc(cc2)C(=O)N2CCNCC2)c2n1cc[nH]c2=O |(-5.12,3.48,;-3.63,3.88,;-3.23,5.36,;-1.75,5.76,;-.66,4.67,;-1.06,3.19,;.03,2.1,;-2.54,2.79,;-2.94,1.3,;-2.04,.05,;-2.94,-1.19,;-2.54,-2.68,;-1.06,-3.08,;-.66,-4.57,;.83,-4.96,;1.92,-3.88,;1.52,-2.39,;.03,-1.99,;3.41,-4.27,;3.81,-5.76,;4.5,-3.19,;5.98,-3.58,;7.07,-2.49,;6.67,-1.01,;5.19,-.61,;4.1,-1.7,;-4.41,-.72,;-4.41,.82,;-5.74,1.59,;-7.07,.82,;-7.07,-.72,;-5.74,-1.49,;-5.74,-3.03,)|

BDBM687886

CC(C)(C(N)=O)c1ccc(Nc2nc(-c3c(F)cccc3Cl)n3cc[nH]c(=O)c23)cc1 |(5.29,-5.04,;3.95,-4.27,;3.55,-5.76,;5.04,-3.19,;6.53,-3.58,;4.64,-1.7,;2.46,-3.88,;1.38,-4.96,;-.11,-4.57,;-.51,-3.08,;-2,-2.68,;-2.4,-1.19,;-1.49,.05,;-2.4,1.3,;-2,2.79,;-3.09,3.88,;-4.57,3.48,;-2.69,5.36,;-1.2,5.76,;-.11,4.67,;-.51,3.19,;.58,2.1,;-3.86,.82,;-5.19,1.59,;-6.53,.82,;-6.53,-.72,;-5.19,-1.49,;-5.19,-3.03,;-3.86,-.72,;.58,-1.99,;2.07,-2.39,)|

BDBM687887

CC(C)(C(N)=O)c1ccc(Nc2nc(-c3c(F)cccc3F)n3cc[nH]c(=O)c23)cc1 |(5.29,-5.04,;3.95,-4.27,;3.55,-5.76,;5.04,-3.19,;6.53,-3.58,;4.64,-1.7,;2.46,-3.88,;1.38,-4.96,;-.11,-4.57,;-.51,-3.08,;-2,-2.68,;-2.4,-1.19,;-1.49,.05,;-2.4,1.3,;-2,2.79,;-3.09,3.88,;-4.57,3.48,;-2.69,5.36,;-1.2,5.76,;-.11,4.67,;-.51,3.19,;.58,2.1,;-3.86,.82,;-5.19,1.59,;-6.53,.82,;-6.53,-.72,;-5.19,-1.49,;-5.19,-3.03,;-3.86,-.72,;.58,-1.99,;2.07,-2.39,)|

BDBM687888

CN1CCN(CC1)C(=O)C(C)(C)c1ccc(Nc2nc(-c3c(F)cccc3F)n3cc[nH]c(=O)c23)cc1 |(8.76,-4.78,;7.27,-4.38,;6.18,-5.47,;4.7,-5.07,;4.3,-3.58,;5.39,-2.49,;6.87,-2.89,;2.81,-3.19,;2.41,-1.7,;1.72,-4.27,;3.05,-5.04,;1.32,-5.76,;.23,-3.88,;-.86,-4.96,;-2.34,-4.57,;-2.74,-3.08,;-4.23,-2.68,;-4.63,-1.19,;-3.72,.05,;-4.63,1.3,;-4.23,2.79,;-5.32,3.88,;-6.81,3.48,;-4.92,5.36,;-3.43,5.76,;-2.34,4.67,;-2.74,3.19,;-1.65,2.1,;-6.09,.82,;-7.43,1.59,;-8.76,.82,;-8.76,-.72,;-7.43,-1.49,;-7.43,-3.03,;-6.09,-.72,;-1.65,-1.99,;-.17,-2.39,)|

BDBM687889

CC(C)(C(=O)N1CCNCC1)c1ccc(Nc2nc(-c3c(F)cccc3F)n3cc[nH]c(=O)c23)cc1 |(3.8,-5.04,;2.46,-4.27,;2.07,-5.76,;3.55,-3.19,;3.15,-1.7,;5.04,-3.58,;5.44,-5.07,;6.93,-5.47,;8.02,-4.38,;7.62,-2.89,;6.13,-2.49,;.98,-3.88,;-.11,-4.96,;-1.6,-4.57,;-2,-3.08,;-3.49,-2.68,;-3.88,-1.19,;-2.98,.05,;-3.88,1.3,;-3.49,2.79,;-4.57,3.88,;-6.06,3.48,;-4.18,5.36,;-2.69,5.76,;-1.6,4.67,;-2,3.19,;-.91,2.1,;-5.35,.82,;-6.68,1.59,;-8.02,.82,;-8.02,-.72,;-6.68,-1.49,;-6.68,-3.03,;-5.35,-.72,;-.91,-1.99,;.58,-2.39,)|

BDBM687890

CN1CCN(CC1)C(=O)C(C)(C)c1ccc(Nc2nc(-c3c(F)cccc3Cl)n3cc[nH]c(=O)c23)cc1 |(8.76,-4.78,;7.27,-4.38,;6.18,-5.47,;4.7,-5.07,;4.3,-3.58,;5.39,-2.49,;6.87,-2.89,;2.81,-3.19,;2.41,-1.7,;1.72,-4.27,;3.05,-5.04,;1.32,-5.76,;.23,-3.88,;-.86,-4.96,;-2.34,-4.57,;-2.74,-3.08,;-4.23,-2.68,;-4.63,-1.19,;-3.72,.05,;-4.63,1.3,;-4.23,2.79,;-5.32,3.88,;-6.81,3.48,;-4.92,5.36,;-3.43,5.76,;-2.34,4.67,;-2.74,3.19,;-1.65,2.1,;-6.09,.82,;-7.43,1.59,;-8.76,.82,;-8.76,-.72,;-7.43,-1.49,;-7.43,-3.03,;-6.09,-.72,;-1.65,-1.99,;-.17,-2.39,)|

BDBM687891

CC(C)(C(=O)N1CCNCC1)c1ccc(Nc2nc(-c3c(F)cccc3Cl)n3cc[nH]c(=O)c23)cc1 |(3.8,-5.04,;2.46,-4.27,;2.07,-5.76,;3.55,-3.19,;3.15,-1.7,;5.04,-3.58,;5.44,-5.07,;6.93,-5.47,;8.02,-4.38,;7.62,-2.89,;6.13,-2.49,;.98,-3.88,;-.11,-4.96,;-1.6,-4.57,;-2,-3.08,;-3.49,-2.68,;-3.88,-1.19,;-2.98,.05,;-3.88,1.3,;-3.49,2.79,;-4.57,3.88,;-6.06,3.48,;-4.18,5.36,;-2.69,5.76,;-1.6,4.67,;-2,3.19,;-.91,2.1,;-5.35,.82,;-6.68,1.59,;-8.02,.82,;-8.02,-.72,;-6.68,-1.49,;-6.68,-3.03,;-5.35,-.72,;-.91,-1.99,;.58,-2.39,)|

BDBM687892

OC(=O)c1ccc(Nc2nc(-c3c(F)cccc3F)n3cc[nH]c(=O)c23)cc1 |(5.78,-3.19,;4.7,-4.27,;5.09,-5.76,;3.21,-3.88,;2.12,-4.96,;.63,-4.57,;.23,-3.08,;-1.25,-2.68,;-1.65,-1.19,;-.75,.05,;-1.65,1.3,;-1.25,2.79,;-2.34,3.88,;-3.83,3.48,;-1.94,5.36,;-.46,5.76,;.63,4.67,;.23,3.19,;1.32,2.1,;-3.12,.82,;-4.45,1.59,;-5.78,.82,;-5.78,-.72,;-4.45,-1.49,;-4.45,-3.03,;-3.12,-.72,;1.32,-1.99,;2.81,-2.39,)|

BDBM687893

CC(C)(C(O)=O)c1ccc(Nc2nc(-c3c(F)cccc3F)n3cc[nH]c(=O)c23)cc1 |(5.29,-5.04,;3.95,-4.27,;3.55,-5.76,;5.04,-3.19,;6.53,-3.58,;4.64,-1.7,;2.46,-3.88,;1.38,-4.96,;-.11,-4.57,;-.51,-3.08,;-2,-2.68,;-2.4,-1.19,;-1.49,.05,;-2.4,1.3,;-2,2.79,;-3.09,3.88,;-4.57,3.48,;-2.69,5.36,;-1.2,5.76,;-.11,4.67,;-.51,3.19,;.58,2.1,;-3.86,.82,;-5.19,1.59,;-6.53,.82,;-6.53,-.72,;-5.19,-1.49,;-5.19,-3.03,;-3.86,-.72,;.58,-1.99,;2.07,-2.39,)|

BDBM702648

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702649

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ncnn3c2)cn1

BDBM702650

O=C([C@@H]1CC1(F)F)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702651

O=C([C@H]1C[C@@H]1F)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702652

CC1C(C(=O)N2C3CCC2CN(c2ncnn4cc(-c5cnn(C(F)F)c5)cc24)C3)C1(F)F

BDBM702653

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@H]4C[C@@H]4F)ncnn3c2)cn1

BDBM702654

O=C(C1C(F)(F)C12CCC2)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702655

O=C([C@H]1CC1(F)F)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702656

O=C(C1CCC1F)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702657

O=C(C1C(F)(F)C12CC2)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702658

O=C(C1CCC1(F)F)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702659

N#CC1CC(C(=O)N2C3CCC2CN(c2ncnn4cc(-c5cnn(C(F)F)c5)cc24)C3)C1

BDBM702660

CC1(C)C(C(=O)N2C3CCC2CN(c2ncnn4cc(-c5cnn(C(F)F)c5)cc24)C3)C1(F)F

BDBM702661

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4CC4)ccnn3c2)cn1

BDBM702662

O=C(C1CC1)N1C2CCC1CN(c1ccnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702663

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702664

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnn3cc(-c4cnn(C(F)(F)F)c4)cc13)C2

BDBM702665

O=C([C@@H]1CC1(F)F)N1C2CCC1CN(c1ccnn3cc(-c4cnn(C(F)(F)F)c4)cc13)C2

BDBM702666

O=C(C1CC1)N1C2CCC1CN(c1ccnn3cc(-c4cnn(C(F)(F)F)c4)cc13)C2

BDBM702667

O=C([C@@H]1CC1(F)F)N1C2CCC1CN(c1ccnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702668

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4CC4(F)F)ccnn3c2)cn1

BDBM702669

Cn5cc(c4cc3c(N1CC2CCC(C1)N2C(=O)CC#N)ccnn3c4)cn5

BDBM702670

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnn3cc(C4CC4)cc13)C2

BDBM702671

O=C([C@@H]1CC1(F)F)N1C2CCC1CN(c1ccnn3cc(C4CC4)cc13)C2

BDBM702672

COc1nccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)c1F

BDBM702673

COc1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)c(F)cn1

BDBM702674

CC(C)(C)OC(=O)N1C2CCC1CN(c1ccnn3cc(-c4cnn(C(F)(F)F)c4)cc13)C2

BDBM702675

CC(C)(C)OC(=O)N1C2CCC1CN(c1ccnn3cc(C4CC4)cc13)C2

BDBM702676

N#CC1(C(=O)N2C3CCC2CN(c2ncnn4cc(-c5cnn(C(F)F)c5)cc24)C3)CC1

BDBM702677

CC(C(=O)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2)C(F)(F)F

BDBM702678

CC(C)(F)C(=O)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702679

C[C@]1(F)C[C@@H](C(=O)N2C3CCC2CN(c2ncnn4cc(-c5cnn(C(F)F)c5)cc24)C3)C1

BDBM702680

C[C@]1(F)C[C@H](C(=O)N2C3CCC2CN(c2ncnn4cc(-c5cnn(C(F)F)c5)cc24)C3)C1

BDBM702681

CCOC1CC1C(=O)N2C6CCC2CN(c4ncnn5cc(c3cnn(C(F)F)c3)cc45)C6

BDBM702682

O=C(C1CC(O)(C(F)(F)F)C1)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702683

COc5nccc(c4cc3c(N2CC1CCC(C1)C2)ccnn3c4)c5F

BDBM702684

COc1cc(-c2cc3c(N4CC5CCC(C5)C4)ccnn3c2)c(F)cn1

BDBM702685

O=C(C1C[C@@H]1CO)N2C6CCC2CN(c4ncnn5cc(c3cnn(C(F)F)c3)cc45)C6

BDBM702686

O=C(C1C[C@H]1CO)N2C6CCC2CN(c4ncnn5cc(c3cnn(C(F)F)c3)cc45)C6

BDBM702687

CCC(=O)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702688

CC(C)C(=O)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702689

O=C(CC(F)(F)F)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702690

N#CCC(=O)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702691

O=C(N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2)C1(C(F)(F)F)CC1

BDBM702692

O=C([C@H]1C[C@H]1F)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702693

N#C[C@@H]1C[C@@H]1C(=O)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702694

O=C(C1CC(F)C1)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702695

O=C(C1CC1(F)F)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702696

O=C(N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2)C1(F)CC1

BDBM702697

O=C(C1CCC1)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702698

CC1(C(=O)N2C3CCC2CN(c2ncnn4cc(-c5cnn(C(F)F)c5)cc24)C3)CCC1

BDBM702699

N#C[C@H]1C[C@@H]1C(=O)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702700

O=C([C@H]1C[C@@H]1F)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702701

O=C(C1CC(F)(F)C1)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702702

CC(F)(F)C(=O)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702703

CCC(=O)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C)c4)cc13)C2

BDBM702704

CC(C)C(=O)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C)c4)cc13)C2

BDBM702705

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)CC(F)(F)F)ncnn3c2)cn1

BDBM702706

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@H]4C[C@H]4F)ncnn3c2)cn1

BDBM702707

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@H]4C[C@@H]4F)ncnn3c2)cn1

BDBM702708

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)CC#N)ncnn3c2)cn1

BDBM702709

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4CC4(F)F)ncnn3c2)cn1

BDBM702710

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4(F)CC4)ncnn3c2)cn1

BDBM702711

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@H]4C[C@H]4C#N)ncnn3c2)cn1

BDBM702712

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@H]4C[C@@H]4C#N)ncnn3c2)cn1

BDBM702713

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4CCC4)ncnn3c2)cn1

BDBM702714

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4(C)CCC4)ncnn3c2)cn1

BDBM702715

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4CC(F)C4)ncnn3c2)cn1

BDBM702716

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4CC(F)(F)C4)ncnn3c2)cn1

BDBM702717

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4COC4)ncnn3c2)cn1

BDBM702718

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C(C)(F)F)ncnn3c2)cn1

BDBM702719

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C(C)(F)F)ncnn3c2)cn1

BDBM702720

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4C#N)ncnn3c2)cn1

BDBM702721

O=C([C@H]1C[C@H]1F)N2C6CCC2CN(c4ncnn5cc(c3cnn(C(F)F)c3)cc45)C6

BDBM702722

O=C([C@H]1C[C@@H]1F)N2C6CCC2CN(c4ncnn5cc(c3cnn(C(F)F)c3)cc45)C6

BDBM702723

O=C([C@H]1CC1(F)F)N2C6CCC2CN(c4ncnn5cc(c3cnn(C(F)F)c3)cc45)C6

BDBM702724

N#C[C@@H]1C[C@@H]1C(=O)N2C6CCC2CN(c4ncnn5cc(c3cnn(C(F)F)c3)cc45)C6

BDBM702725

Cn6cc(c5cc4c(N1CC2CCC(C1)N2C(=O)[C@@H]3C[C@H]3F)ncnn4c5)cn6

BDBM702726

Cn6cc(c5cc4c(N1CC2CCC(C1)N2C(=O)[C@@H]3C[C@@H]3F)ncnn4c5)cn6

BDBM702727

Cn6cc(c5cc4c(N1CC2CCC(C1)N2C(=O)[C@H]3C[C@H]3F)ncnn4c5)cn6

BDBM702728

Cn6cc(c5cc4c(N1CC2CCC(C1)N2C(=O)[C@@H]3C[C@H]3F)ncnn4c5)cn6

BDBM702729

Cn6cc(c5cc4c(N1CC2CCC(C1)N2C(=O)[C@@H]3CC3(F)F)ncnn4c5)cn6

BDBM702730

Cn6cc(c5cc4c(N1CC2CCC(C1)N2C(=O)[C@H]3CC3(F)F)ncnn4c5)cn6

BDBM702731

Cn6cc(c5cc4c(N1CC2CCC(C1)N2C(=O)[C@H]3C[C@H]3C#N)ncnn4c5)cn6

BDBM702732

O=C(N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2)C(F)(F)F

BDBM702733

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C(F)(F)F)ncnn3c2)cn1

BDBM702734

COc1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)ccn1

BDBM702735

COc1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ncnn3c2)ccn1

BDBM702736

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ncnn3cc(-c4ccnnc4)cc13)C2

BDBM702737

Cc1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ncnn3c2)ccn1

BDBM702738

Cc1ccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ncnn3c2)cn1

BDBM702739

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ncnn3cc(-c4ccnc(C(F)F)c4)cc13)C2

BDBM702740

CNc1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ncnn3c2)ccn1

BDBM702741

N#Cc1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ncnn3c2)ccn1

BDBM702742

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ncnn3c2)c(F)n1

BDBM702743

Cn1ncc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ncnn3c2)c1F

BDBM702744

COc1nn(C)cc1c6cc5c(N2CC3CCC(C2)N3C(=O)[C@@H]4C[C@H]4F)ncnn5c6

BDBM702745

CNc1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)ccn1

BDBM702746

Cc1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)ccn1

BDBM702747

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnn3cc(-c4ccnc(C(F)F)c4)cc13)C2

BDBM702748

N#Cc1ccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)nc1

BDBM702749

N#Cc1ccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)cn1

BDBM702750

N#Cc1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)ccn1

BDBM702751

COc1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)ncn1

BDBM702752

Cc1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)ncn1

BDBM702753

COc1ncnc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)c1F

BDBM702754

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnn3cc(-c4ncc(F)cn4)cc13)C2

BDBM702755

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnn3cc(-c4ccnnc4)cc13)C2

BDBM702756

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ncnn3cc(-c4ccc(=O)n(C(F)F)c4)cc13)C2

BDBM702757

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnn3cc(-c4ccnc(OC(F)F)c4)cc13)C2

BDBM702758

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnn3cc(-c4ccnc(C(F)(F)F)c4)cc13)C2

BDBM702759

Cc1ccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)cn1

BDBM702760

COc1ccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)cn1

BDBM702761

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnn3cc(-c4ccc(OC(F)F)nc4)cc13)C2

BDBM702762

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnn3cc(-c4ccc(C(F)F)nc4)cc13)C2

BDBM702763

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnn3cc(-c4ccc(C(F)(F)F)nc4)cc13)C2

BDBM702764

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)c(F)n1

BDBM702765

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnn3cc(-c4ccnc(N5CCC5)c4)cc13)C2

BDBM702766

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnn3cc(-c4ccnc(N5CC(F)(F)C5)c4)cc13)C2

BDBM702767

Cn1ncc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)c1F

BDBM702768

COc1ccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)nn1

BDBM702769

COc1cncc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)n1

BDBM702770

COc1cnc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)cn1

BDBM702771

COc1ccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)nn1

BDBM702772

CNc1nccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)n1

BDBM702773

CNc1cncc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)n1

BDBM702774

CN(C)c1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)ccn1

BDBM702775

CNc1ccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)cn1

BDBM702776

Cc1cncc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)n1

BDBM702777

Cc1cnc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)cn1

BDBM702778

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnn3cc(-c4ccc(=O)n(C(F)F)c4)cc13)C2

BDBM702779

Cn1ncc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)c1F

BDBM702780

CN(C)c1ccc(-c2cc3c(N4CC5CCC(C5)C4)ncnc3[nH]2)cn1

BDBM702781

FC(F)(F)c1ccc(-c2cc3c(N4CC5CCC(C5)C4)ncnc3[nH]2)cn1

BDBM702782

FC(F)(F)c1ccc(-c2cc3c(N4CC5CCC(C5)C4)ncnc3[nH]2)cn1

BDBM702783

COc1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)cnn1

BDBM702784

CN(C)c1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)cnn1

BDBM702785

COc1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)c(F)cnc3[nH]2)ccn1

BDBM702786

O=C(C1CC1)N1C2CCC1CN(c1c(F)cnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702787

Cn1cc(-c2cn3ncc(F)c(N4CC5CCC(C4)N5C(=O)[C@H]4C[C@@H]4F)c3n2)cn1

BDBM702788

COc1cc(-c2cn3ncc(F)c(N4CC5CCC(C4)N5C(=O)[C@H]4C[C@@H]4F)c3n2)ccn1

BDBM702789

Cn1cnc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4CC4)ncnn3c2)c1

BDBM702790

O=C(C1CC1)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702791

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4CC4)ncnn3c2)c(F)n1

BDBM702792

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4CC4)ncnn3c2)c(F)n1

BDBM702793

CCn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4CC4)ncnn3c2)cn1

BDBM702794

CC(C)n1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4CC4)ncnn3c2)cn1

BDBM702795

O=C(C1CC1)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C5CCC5)c4)cc13)C2

BDBM702796

O=C(C1CC1)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702797

O=C(C1CC1)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C5COC5)c4)cc13)C2

BDBM702798

O=C(C1CC1)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C5CCOC5)c4)cc13)C2

BDBM702799

O=C(C1CC1)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C5CCOCC5)c4)cc13)C2

BDBM702800

O=C(C1CC1)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)(F)F)c4)cc13)C2

BDBM702801

O=C(C1CC1)N1C2CCC1CN(c1ncnn3cc(-c4cnn(CF)c4)cc13)C2

BDBM702802

O=C(C1CC1)N2C7CCC2CN(c5ncnn6cc(c4cnn([C@@H]3CCOC3)c4)cc56)C7

BDBM702803

O=C(C1CC1)N2C7CCC2CN(c5ncnn6cc(c4cnn([C@H]3CCOC3)c4)cc56)C7

BDBM702804

Cc6cc(c5cc4c(N1CC2CCC(C1)N2C(=O)C3CC3)ncnn4c5)on6

BDBM702805

Cn6cc(c5cc4c(N1CC2CCC(C1)N2C(=O)[C@@H]3C[C@H]3F)ncnn4c5)cn6

BDBM702806

O=C(C1CC1)N1C2CCC1CN(c1ncnn3cc(-c4cnn(CC5COC5)c4)cc13)C2

BDBM702807

CCn1ncc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4CC4)ncnn3c2)c1F

BDBM702808

CC(C)n1ncc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4CC4)ncnn3c2)c1F

BDBM702809

O=C(C1CC1)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)c(F)c13)C2

BDBM702810

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ncnn3cc(-c4ccnc(F)c4)cc13)C2

BDBM702811

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ncnn3c2)ccc1=O

BDBM702812

Cc1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ncnn3c2)on1

BDBM702813

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ncnn3c2)cc(F)c1=O

BDBM702814

Cc1c(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4CC4)ncnn3c2)cnn1C

BDBM702815

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnn3cc(-c4ccc(F)nc4)cc13)C2

BDBM702816

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnn3cc(-c4ccnc(F)c4)cc13)C2

BDBM702817

Cn1ccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)cc1=O

BDBM702818

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)ccc1=O

BDBM702819

Cc1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)on1

BDBM702820

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)cc(F)c1=O

BDBM702821

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnn3c2)cc(F)c1=O

BDBM702822

N#Cc1cccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4CC4)ncnn3c2)c1

BDBM702823

O=C(C1CC1)N1C2CCC1CN(c1ncnn3cc(-c4ccccc4)cc13)C2

BDBM702824

COc1ccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4CC4)ncnn3c2)cn1

BDBM702825

O=C(C1CC1)N1C2CCC1CN(c1ncnn3cc(-c4ccc(Cl)nc4)cc13)C2

BDBM702826

O=C(C1CC1)N1C2CCC1CN(c1ncnn3cc(-c4ccnc(Cl)c4)cc13)C2

BDBM702827

O=C(C1CC1)N1C2CCC1CN(c1ncnn3cc(-c4ccncc4)cc13)C2

BDBM702828

O=C(C1CC1)N1C2CCC1CN(c1ncnn3cc(-c4ccccc4F)cc13)C2

BDBM702829

O=C(C1CC1)N1C2CCC1CN(c1ncnn3cc(-c4cccnc4)cc13)C2

BDBM702830

O=C(C1CC1)N1C2CCC1CN(c1ncnn3cc(-c4ccc5nncn5c4)cc13)C2

BDBM702831

COc1ccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4CC4)ncnn3c2)cc1C#N

BDBM702832

COc1ccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4CC4)ncnn3c2)cc1C#N

BDBM702833

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5S(=O)(=O)C4CC4)ncnn3c2)cn1

BDBM702834

O=S(=O)(C1CC1)N1C2CCC1CN(c1ncnn3cc(-c4cnn(C(F)F)c4)cc13)C2

BDBM702835

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5S(=O)(=O)C4CC4)ccnn3c2)cn1

BDBM702836

COc1cc(-c2cc3c(N4CC5CCC(C4)N5S(=O)(=O)C4CC4)ccnn3c2)ccn1

BDBM702837

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5S(=O)(=O)C4CC4)ncnc3[nH]2)cn1

BDBM702838

COc1cc(-c2cc3c(N4CC5CCC(C4)N5S(=O)(=O)C4CC4)ncnc3[nH]2)ccn1

BDBM702839

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5S(=O)(=O)C4CC4)ccnc3[nH]2)cn1

BDBM702840

COc1cc(-c2cc3c(N4CC5CCC(C4)N5S(=O)(=O)C4CC4)ccnc3[nH]2)ccn1

BDBM702841

Cn1cc(-c2nc3c(N4CC5CCC(C4)N5S(=O)(=O)C4CC4)ccnc3[nH]2)cn1

BDBM702842

COc1cc(-c2nc3c(N4CC5CCC(C4)N5S(=O)(=O)C4CC4)ccnc3[nH]2)ccn1

BDBM702843

COc1cc(-c2nc3c(N4CC5CCC(C4)N5S(=O)(=O)C4CC4)ccnc3[nH]2)ccn1

BDBM702844

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5S(=O)(=O)[C@@H]4CC4(F)F)ccnn3c2)cn1

BDBM702845

Cn1cc(-c2nc3c(N4CC5CCC(C4)N5C(=O)C4CC4)ccnc3[nH]2)cn1

BDBM702846

Cn1cc(-c2nc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnc3[nH]2)cn1

BDBM702847

Cn1cc(-c2nc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4CC4(F)F)ccnc3[nH]2)cn1

BDBM702848

Cc1cc(-c2nc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnc3[nH]2)ccn1

BDBM702849

COc1cc(-c2nc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnc3[nH]2)ccn1

BDBM702850

N#Cc1cc(-c2nc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnc3[nH]2)ccn1

BDBM702851

Cc1ccc(-c2nc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnc3[nH]2)cn1

BDBM702852

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnc3[nH]c(-c4ccc(C(F)F)nc4)nc13)C2

BDBM702853

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnc3[nH]c(-c4ccnnc4)nc13)C2

BDBM702854

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnc3[nH]c(C4CC4)nc13)C2

BDBM702855

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnc3[nH]c(C4CCC4)nc13)C2

BDBM702856

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnc3[nH]c(C4(F)CC4)nc13)C2

BDBM702857

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnc3[nH]c(C4CCOC4)nc13)C2

BDBM702858

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ccnc3[nH]c(N4CCOCC4)nc13)C2

BDBM702859

Cn1cc(-c2nc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)c(F)cnc3[nH]2)c(F)n1

BDBM702860

Cn1cc(-c2nc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)c(F)cnc3[nH]2)c(F)n1

BDBM702861

N#CC1CC1c1nc2c(N3CC4CCC(C3)N4C(=O)[C@@H]3C[C@H]3F)ccnc2[nH]1

BDBM702862

Cn1cc(-c2nc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnc3[nH]2)c(F)n1

BDBM702863

CNc1cc(-c2nc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnc3[nH]2)ccn1

BDBM702864

CN1CCOC(c2nc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnc3[nH]2)C1

BDBM702865

O=C(C1CC1)N1C2CCC1CN(c1ncnc3[nH]c(-c4cnn(C(F)F)c4)cc13)C2

BDBM702866

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4CC4)ncnc3[nH]2)cn1

BDBM702867

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ncnc3[nH]c(-c4cnn(C(F)F)c4)cc13)C2

BDBM702868

O=C([C@@H]1CC1(F)F)N1C2CCC1CN(c1ncnc3[nH]c(-c4cnn(C(F)F)c4)cc13)C2

BDBM702869

O=C([C@@H]1C[C@H]1F)N1C2CCC1CN(c1ncnc3[nH]c(-c4ccnc(C(F)(F)F)c4)cc13)C2

BDBM702870

COc1ccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ncnc3[nH]2)cn1

BDBM702871

COc1ccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ncnc3[nH]2)cn1

BDBM702872

CN(C)c1ccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4C[C@H]4F)ncnc3[nH]2)cn1

BDBM702873

N#Cc1ccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4C[C@H]4F)ncnc3[nH]2)cn1

BDBM702874

O=C(C1C[C@H]1F)N1C2CCC1CN(c1ncnc3[nH]c(-c4ccc(C(F)(F)F)nc4)cc13)C2

BDBM702875

O=C(C1C[C@H]1F)N1C2CCC1CN(c1ncnc3[nH]c(-c4cncc(F)c4)cc13)C2

BDBM702876

Cc1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4C[C@H]4F)ncnc3[nH]2)ccn1

BDBM702877

COc1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4C[C@H]4F)ncnc3[nH]2)ccn1

BDBM702878

O=C(C1C[C@H]1F)N1C2CCC1CN(c1ncnc3[nH]c(-c4ccncc4F)cc13)C2

BDBM702879

N#Cc1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4C[C@H]4F)ncnc3[nH]2)ccn1

BDBM702880

O=C(C1C[C@H]1F)N1C2CCC1CN(c1ncnc3[nH]c(-c4ccnnc4)cc13)C2

BDBM702881

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4C[C@H]4F)ncnc3[nH]2)cn1

BDBM702882

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4C[C@H]4F)ncnc3[nH]2)cn1

BDBM702883

O=C(C1CC1)N1C2CCC1CN(c1ccnc3[nH]c(-c4cnn(C(F)F)c4)cc13)C2

BDBM702884

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnc3[nH]2)cn1

BDBM702885

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4CC4(F)F)ccnc3[nH]2)cn1

BDBM702886

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4(F)CC4)ccnc3[nH]2)cn1

BDBM702887

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4CC4(F)F)ccnc3[nH]2)c(F)n1

BDBM702888

Cn1ncc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4(F)CC4)ccnc3[nH]2)c1F

BDBM702889

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)C4(F)CC4)ccnc3[nH]2)c(F)n1

BDBM702890

Cn1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnc3[nH]2)c(F)n1

BDBM702891

COc1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnc3[nH]2)ccn1

BDBM702892

COc1cc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnc3[nH]2)c(F)cn1

BDBM702893

COc1nccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnc3[nH]2)c1F

BDBM702894

COc1nccc(-c2cc3c(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)ccnc3[nH]2)c1F

BDBM702895

CC1=C(c2cnn(C)c2)NC2N=CC=C(N3CC4CCC(C3)N4C(=O)[C@@H]3C[C@H]3F)C12

BDBM702896

Cn1cc(C2=C(C#N)C3C(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)=CC=NC3N2)cn1

BDBM702897

Cn1cc(-c2cc3nccc(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)n3n2)cn1

BDBM702898

Cn1cc(-c2cn3nccc(N4CC5CCC(C4)N5C(=O)[C@@H]4C[C@H]4F)c3n2)cn1

BDBM50620356

Cc1cc(Nc2ncc(C)c(n2)N2CC(CC#N)C2)sn1

BDBM50620360

Cc1cc(Nc2ncc(C)c(n2)N2CC(CC#N)(C2)N2CCCC2)sn1

BDBM708618

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCOCC4)C3)n2)sn1

BDBM50620345

Cc1cc(sn1)Nc2ncc(c(n2)N3CC(C3)(CC#N)N4CCN(CC4)C)C

BDBM50620361

Cc1cc(Nc2ncc(C)c(n2)N2CC(CC#N)(C2)N2CCCCC2)sn1

BDBM708621

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CC(C5CC5)C4)C3)n2)sn1

BDBM708622

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCC4)C3)n2)sn1

BDBM708623

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N(C)C4CC4)C3)n2)sn1

BDBM708624

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCC(CCF)CC4)C3)n2)sn1

BDBM708625

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCCC(C)C4)C3)n2)sn1

BDBM708626

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CC(C)CC(C)C4)C3)n2)sn1

BDBM708627

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCC(F)CC4)C3)n2)sn1

BDBM708628

Cc1cnc(Nc2cc(C3CC3)ns2)nc1N1CC(CC#N)(N2CCN(C)CC2)C1

BDBM708629

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CC5CC(C5)C4)C3)n2)sn1

BDBM708630

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCC(CC(F)F)CC4)C3)n2)sn1

BDBM708631

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCCC5(CC5)C4)C3)n2)sn1

BDBM708632

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCC5(CC4)CC5(F)F)C3)n2)sn1

BDBM708633

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CC(C)CC5(CC5)C4)C3)n2)sn1

BDBM708634

COc1cnc(Nc2cc(C)ns2)nc1N1CC(CC#N)(N2CCCCC2)C1

BDBM708635

Cc1cc(Nc2ncc(Cl)c(N3CC(CC#N)(N4CCCCC4)C3)n2)sn1

BDBM708636

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCC5(CC4)COC5)C3)n2)sn1

BDBM708637

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCCC5(C4)CC5(F)F)C3)n2)sn1

BDBM708638

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCC5(CC4)CN(C)C5)C3)n2)sn1

BDBM708639

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CC5C(C4)C5(F)F)C3)n2)sn1

BDBM708640

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CC5CCC(C4)N5C)C3)n2)sn1

BDBM708641

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CC5CC(C4)C5(F)F)C3)n2)sn1

BDBM708642

Cc1cc(Nc2ncc(C3CC3)c(N3CC(CC#N)(N4CCCCC4)C3)n2)sn1

BDBM708643

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCCCCC4)C3)n2)sn1

BDBM708644

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4C[C@@H](C)N(C)[C@@H](C)C4)C3)n2)sn1

BDBM708645

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4C[C@@H](C)N(C)[C@H](C)C4)C3)n2)sn1

BDBM708646

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCN(C)C(C)C4)C3)n2)sn1

BDBM708647

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N(C)C4CN(C)C4)C3)n2)sn1

BDBM708648

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCN(C)C5(CC5)C4)C3)n2)sn1

BDBM708649

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCC5(CC4)CC5)C3)n2)sn1

BDBM708652

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCC(C5CC5(F)F)CC4)C3)n2)sn1

BDBM708653

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCCC5(COC5)C4)C3)n2)sn1

BDBM708654

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CC5(CN(C)C5)C4)C3)n2)sn1

BDBM708655

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CC(N(C)C)C4)C3)n2)sn1

BDBM708656

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4C[C@H](C)N(C)[C@@H](C)C4)C3)n2)sn1

BDBM708657

Cc1cc(Nc2nccc(N3CC(CC#N)(N4CCCCC4)C3)n2)sn1

BDBM708658

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCN(C)C5(COC5)C4)C3)n2)sn1

BDBM708659

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCC(CS(C)(=O)=O)CC4)C3)n2)sn1

BDBM708660

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCN(CC5CC5)CC4)C3)n2)sn1

BDBM708661

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4C5CCCC4C5)C3)n2)sn1

BDBM708662

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4C5CC4CN(C)C5)C3)n2)sn1

BDBM708663

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCN(CC(C)C)CC4)C3)n2)sn1

BDBM708664

CCN1CCN(C2(CC#N)CN(c3nc(Nc4cc(C)ns4)ncc3C)C2)CC1

BDBM708665

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCN(C)[C@@H](C)C4)C3)n2)sn1

BDBM708666

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCN5C[C@@H](F)C[C@H]5C4)C3)n2)sn1

BDBM708667

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCN(C)[C@H](C)C4)C3)n2)sn1

BDBM708668

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCN(CC(C)(C)F)CC4)C3)n2)sn1

BDBM708669

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCC5C(CC4)C5(F)F)C3)n2)sn1

BDBM708670

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CC5CC(C4)N5C)C3)n2)sn1

BDBM708671

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCCN(C)CC4)C3)n2)sn1

BDBM708672

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(NC4CN(C)C4)C3)n2)sn1

BDBM708673

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCN(C5CC5)CC4)C3)n2)sn1

BDBM708674

Cc1cc(Nc2ncc(C)c(N3CC(CC#N)(N4CCN(C(C)C)CC4)C3)n2)sn1

BDBM50620362

CN1CCN(CC1)C1(CC#N)CN(C1)c1nc(Nc2cnn(C)c2)ncc1C

BDBM708676

Cc1cnc(Nc2cnn(C)c2)nc1N1CC(CC#N)(N2CCC3(CC2)CC3(F)F)C1

BDBM708677

Cc1cnc(Nc2cnn(C)c2)nc1N1CC2(C1)CC2(F)F

BDBM712364

Cn1cc(-c2cn3nccc3c(-c3cnn([C@]4(CC#N)CC5(C[C@H](C#N)C5)C4)c3)n2)cn1

BDBM712427

Cn1cc(-c2cn3nccc3c(-c3cnn([C@]4(CC#N)CC5(C[C@H](C#N)C5)C4)c3)n2)cn1

BDBM712428

Cn1ccc(-c2cn3nccc3c(-c3cnn(C(CC#N)C45CC(C#N)(C4)C5)c3)n2)n1

BDBM712429

Cn1cc(-c2cn3nccc3c(-c3cnn([C@]4(CC#N)CC5(C[C@H](C#N)C5)C4)c3)n2)cn1

BDBM712430

Cn1ccc(-c2cn3nccc3c(-c3cnn([C@]4(CC#N)CC5(C[C@H](C#N)C5)C4)c3)n2)n1

BDBM712431

N#CCN1CC2(C1)CC(CC#N)(n1cc(-c3nc(-c4ccn(C)n4)cn4nccc34)cn1)C2

BDBM712432

Cn1ccc(-c2cn3nccc3c(-c3cnn(C4(CC#N)CC5(CN(C#N)C5)C4)c3)n2)n1

BDBM712433

Cn1ccc(-c2cn3nccc3c(-c3cnn(C4(CC#N)CC5C(C#N)C5C4)c3)n2)n1

BDBM712434

N#CN1CCC2(CC1)CC(CC#N)(n1cc(-c3nc(-c4ccn(C)n4)cn4nccc34)cn1)C2

BDBM712435

Cn1ccc(-c2cn3nccc3c(-c3cnn(C4(CC#N)CC5(CCN(C#N)C5)C4)c3)n2)n1

BDBM712436

Cn1ccc(-c2cn3nccc3c(-c3cnn([C@]4(CC#N)CC5(CC[C@H](C#N)CC5)C4)c3)n2)n1

BDBM712437

Cn1ccc(-c2cn3nccc3c(-c3cnn([C@]4(CC#N)CC5(CC[C@H](C#N)CC5)C4)c3)n2)n1

BDBM712438

Cn1nc(-c2cn3nccc3c(-c3cnn([C@]4(CC#N)CC5(C[C@@H](C#N)C5)C4)c3)n2)cc1N

BDBM712439

Cn1nc(-c2cn3nccc3c(-c3cnn([C@]4(CC#N)CC5(C[C@@H](C#N)C5)C4)c3)n2)cc1N

BDBM712440

Cn1cc(-c2cc(-c3cnn([C@]4(CC#N)CC5(C[C@@H](C#N)C5)C4)c3)c3ccnn3c2)cn1

BDBM712441

Cn1cc(-c2cc(-c3cnn([C@]4(CC#N)CC5(C[C@@H](C#N)C5)C4)c3)c3ccnn3c2)cn1

BDBM712442

Cn1ncc(-c2cn3nccc3c(-c3cnn([C@]4(CC#N)CC5(C[C@@H](C#N)C5)C4)c3)n2)c1N

BDBM712443

Cn1ncc(-c2cn3nccc3c(-c3cnn([C@]4(CC#N)CC5(C[C@@H](C#N)C5)C4)c3)n2)c1N

BDBM712444

N#CC[C@]1(n2cc(-c3nc(-c4cc(N)[nH]n4)cn4nccc34)cn2)CC2(C[C@H](C#N)C2)C1

BDBM712445

N#CC[C@]1(n2cc(-c3nc(-c4cc(N)[nH]n4)cn4nccc34)cn2)CC2(C[C@H](C#N)C2)C1

BDBM50441557

CCc1nc(N[C@@H]2CCC[C@@H]2C#N)c2cc[nH]c(=O)c2n1 |r|

BDBM50021626

CC(C)(C)CNC(=O)CC1CNC(=O)c2cc(cn12)-c1ccsc1

BDBM50021618

CN1CCN(C[C@@H](NC(=O)C[C@H]2CNC(=O)c3cc(cn23)-c2cccc(Cl)c2)C2CCCCC2)CC1 |r|

BDBM50021657

O=C(Nc1nc2CC=CC(c3ccc(CN4CCS(=O)(=O)CC4)cc3)n2n1)C1CC1 |c:7|

BDBM50308060

C[C@@]12[C@](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)(CO)O

BDBM50300690

CC(C)(C)c1cc(NC(=O)Nc2ccc(cc2)-c2cn3c(n2)sc2cc(OCCN4CCOCC4)ccc32)no1

BDBM13535

COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1

BDBM50326053

C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)N(C)C(=O)c9ccccc9)OC

BDBM50326054

CO[C@@H]1[C@@H](C[C@H]2O[C@]1(C)n1c3ccccc3c3c4[C@H](O)NC(=O)c4c4c5ccccc5n2c4c13)N(C)C(=O)c1ccccc1 |r|

BDBM16673

CNC(=O)c1cc(ccn1)Oc2ccc(cc2)NC(=O)Nc3ccc(c(c3)C(F)(F)F)Cl

BDBM50335374

COc1cc(O)c2c(CCC[C@H](O)CC(=O)C=CC[C@H](C)OC2=O)c1 |r,w:17.17|

BDBM50355393

CCN1CCN(CC1)c2ccc(cc2)Nc3cc(ncn3)N(C)C(=O)Nc4c(c(cc(c4Cl)OC)OC)Cl

BDBM482158

CC(C)S(=O)(=O)c1ccccc1Nc2c(cnc(n2)Nc3ccc(cc3OC)N4CCC(CC4)N5CCN(CC5)C)Cl

BDBM50242737

Cc1[nH]c(\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)Cc2c(Cl)cccc2Cl)c(C)c1C(=O)N1CCC[C@@H]1CN1CCCC1 |r|

BDBM50306682

C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl |r|

BDBM5445

CS(=O)(=O)CCNCc1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1

BDBM13336

CS(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1

BDBM50132260

Fc1ccc(C(=O)NOCC2CC2)c(Nc2ccc(I)cc2Cl)c1F

BDBM32362

COc1ccc(cc1)COc2ccc(cc2OC)Cc3cnc(nc3N)N

BDBM13533

Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(OCCN2CCOCC2)c2ccccc12)C(C)(C)C

BDBM5446

COCCOc1cc2c(cc1OCCOC)ncnc2Nc3cccc(c3)C#C

BDBM25919

Cc1cnc2c(NCCN)nc3ccc(C)cc3n12

BDBM25045

Oc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1

BDBM31088

Cn1c(Nc2ccc(cc2)C(F)(F)F)nc2cc(Oc3ccnc(c3)-c3ncc([nH]3)C(F)(F)F)ccc12

BDBM24773

CC1(CNc2c1ccc(c2)NC(=O)c3cccnc3NCc4ccncc4)C

BDBM17055

CN(C)C[C@@H]1CCn2cc(C3=C(C(=O)NC3=O)c3cn(CCO1)c1ccccc31)c1ccccc21 |r,t:10|

BDBM26474

CN(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(C)c(c2)S(N)(=O)=O)n1

BDBM15244

c1cc(c(c(c1)Cl)C2=C3C=CC(=NN3C=NC2=O)Sc4ccc(cc4F)F)Cl

BDBM31093

OC(=O)c1ccc(Nc2ncc3CN=C(c4cc(Cl)ccc4-c3n2)c2c(F)cccc2F)cc1 |c:13|

BDBM50355504

COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)NC4=CCC(F)C=C4)cc3F)ccnc2cc1OCCCN1CCOCC1 |c:26,t:21|

BDBM50355495

Cc1ccc(cc1Nc2nc(cs2)c3cccnc3)NC(=O)c4ccc(cc4)CN5CCN(CC5)C

BDBM50355494

COc1cc(Oc2ccnc3cc(OC)c(OC)cc23)ccc1NC(=O)NC(C)c1nccs1

BDBM50355496

O=C(N1CCNCC1)c1ccc(\C=C\c2n[nH]c3ccccc23)cc1

BDBM50355500

C[C@@H](Oc1cc(sc1C(N)=O)-n1cnc2ccc(CN3CCN(C)CC3)cc12)c1ccccc1C(F)(F)F |r|

BDBM50355499

CN(C)CC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:31|

BDBM5655

CN1CC[C@@H]([C@H](O)C1)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1Cl |r|

BDBM24654

Clc1cccc(Cl)c1C(=O)Nc1cn[nH]c1C(=O)NC1CCNCC1

BDBM50184807

C[C@@H](O)COc1cn2ncnc(Oc3ccc4[nH]c(C)cc4c3F)c2c1C

BDBM12621

COc1ccc(c(c1C(=O)c2cnc(nc2N)NC3CCN(CC3)S(=O)(=O)C)F)F

BDBM25013

CCn1c(nc2c(ncc(OC[C@H]3CCCNC3)c12)C#CC(C)(C)O)-c1nonc1N |r|

BDBM50026612

CN1CCN(CC1)CC(=O)N(C)c2ccc(cc2)N/C(=C\3/c4ccc(cc4NC3=O)C(=O)OC)/c5ccccc5

BDBM4779

C=CC(=O)Nc1cc2c(cc1OCCCN3CCOCC3)ncnc2Nc4ccc(c(c4)Cl)F

BDBM50322823

CN(C)C/C=C/C(=O)Nc1cc2c(cc1O[C@H]3CCOC3)ncnc2Nc4ccc(c(c4)Cl)F

BDBM36409

CC(C)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12

BDBM25117

CNC(=O)c1ccccc1Sc2ccc3c(c2)[nH]nc3/C=C/c4ccccn4

BDBM27817

CNC(=O)c1c(F)cccc1Nc1nc(Nc2cc3N(CCc3cc2OC)C(=O)CN(C)C)nc2[nH]ccc12

BDBM25028

CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1

BDBM6568

CN1c2c(cnc(n2)Nc3cccc(c3)SC)C=C(C1=O)c4c(cccc4Cl)Cl

BDBM5931

CC(C)(C)c1cnc(o1)CSc2cnc(s2)NC(=O)C3CCNCC3

BDBM50128285

Cn1cc(C2=C(C(=O)NC2=O)c2cn(C3CCN(Cc4ccccn4)CC3)c3ccccc23)c2ccccc12 |t:4|

BDBM25084

Nc1nc(N)c2nc(-c3cccc(O)c3)c(nc2n1)-c1cccc(O)c1

BDBM60589

Cn1cc(cn1)-c1ccc2nnc(Sc3ccc4ncccc4c3)n2n1

BDBM2579

C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)NC)OC

BDBM25617

CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(Cl)cc23)c1F

BDBM5447

COc1cc2c(cc1OCCCN3CCOCC3)c(ncn2)Nc4ccc(c(c4)Cl)F

BDBM50161957

CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C

BDBM13216

Cc1cccc(c1NC(=O)c2cnc(s2)Nc3cc(nc(n3)C)N4CCN(CC4)CCO)Cl

BDBM25118

CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O

BDBM50355497

Cn1cnc2c1cc(c(c2F)Nc3ccc(cc3Cl)Br)C(=O)NOCCO

BDBM4851

Clc1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1

BDBM50331096

COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ncnc2cc1OCCCN1CCCC1

BDBM60665

CC1(C(=O)Nc2c(ccc(n2)Nc3c(cnc(n3)Nc4cc(c(c(c4)OC)OC)OC)F)O1)C

BDBM25121

CC[C@H]1N(C2CCCC2)c2nc(Nc3ccc(cc3OC)C(=O)NC3CCN(C)CC3)ncc2N(C)C1=O |r|

BDBM26300

CCN(CCCOc1ccc2c(c1)ncnc2Nc3cc(n[nH]3)CC(=O)Nc4cccc(c4)F)CCO

BDBM21079

Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2cccc3[nH]nc(N)c23)c1

BDBM50309910

COc1c(Cl)cc2c3ccncc3[nH]c2c1NC(=O)c1cccnc1C

BDBM21

CN1CCC(CC1)COc2cc3c(cc2OC)c(ncn3)Nc4ccc(cc4F)Br

BDBM13534

CN1CCN(CC1)c1cc(Nc2cc(C)n[nH]2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1

BDBM25628

OCCn1cc(c(n1)-c1ccncc1)-c1ccc2C(CCc2c1)N=O

BDBM15138

Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccccc2)c1 |r|

BDBM4552

CN1CCN(CC1)CCCOc2cc3c(cc2OC)c(c(cn3)C#N)Nc4cc(c(cc4Cl)Cl)OC

BDBM17060

Fc1ccc(c(F)c1)-c1cc(cc2N(C(=O)NCc12)c1c(Cl)cccc1Cl)C1CCNCC1

BDBM50031747

COc1ccc(cc1)-c1cccc2nc(NC(=O)C3CC3)nn12

BDBM50032612

COC1CCN(CC1)c1nccc(Nc2cc(NC(=O)c3c(Cl)cccc3Cl)ccn2)n1

BDBM50032611

COC1CCN(CC1)c1nccc(Nc2cc3[nH]c(nc3cn2)-c2cn[nH]c2)n1

BDBM50032624

COC1CCN(CC1)c1nccc(Nc2cc3[nH]c(cc3cn2)-c2cn[nH]c2)n1

BDBM50032628

COC1CCN(CC1)c1nccc(Nc2cc3n(cnc3cn2)C(C)C)n1

BDBM50032630

COC1CCN(CC1)c1nccc(Nc2cc3n(nc(N)c3cn2)C(C)C)n1

BDBM50035811

CC1(C)[C@H](N)CC[C@H]1Nc1c(cnn2cccc12)C(N)=O |r|

BDBM50035812

CC1(C)[C@@H](N)CC[C@H]1Nc1c(cnn2cccc12)C(N)=O |r|

BDBM50035813

C[C@@]1(N)CC[C@@H](Nc2c(cnn3cccc23)C(N)=O)C1(C)C |r|

BDBM50035814

C[C@]1(N)CC[C@@H](Nc2c(cnn3cccc23)C(N)=O)C1(C)C |r|

BDBM50035815

C[C@]1(O)CCC[C@H]1Nc1c(cnn2cccc12)C(N)=O |r|

BDBM50035816

C[C@@]1(O)CCC[C@H]1Nc1c(cnn2cccc12)C(N)=O |r|

BDBM50035817

C[C@]1(CO)CCC[C@H]1Nc1c(cnn2cccc12)C(N)=O |r|

BDBM50035818

C[C@@]1(CO)CCC[C@H]1Nc1c(cnn2cccc12)C(N)=O |r|

BDBM50035837

C[C@@]1(CCC[C@H]1Nc1c(cnn2cccc12)C(N)=O)C#N |r|

BDBM50035838

C[C@]1(CCC[C@H]1Nc1c(cnn2cccc12)C(N)=O)C#N |r|

BDBM50035810

C[C@@]1(CCC[C@H]1Nc2c3cccn3ncc2C(=O)N)F

BDBM50035839

C[C@@]1(F)CCC[C@@H]1Nc1c(cnn2cccc12)C(N)=O |r|

BDBM50035840

C[C@@]1(F)CCC[C@H]1Nc1c(cnn2cccc12)C(N)=O |r|

BDBM50035841

C[C@@H](Nc1c(cnn2cccc12)C(N)=O)C(C)(C)C |r|

BDBM50035842

CC1(C)CCC[C@H]1Nc1c(cnn2cccc12)C(N)=O |r|

BDBM50035843

C[C@H](Nc1c(cnn2cccc12)C(N)=O)C(C)(C)C |r|

BDBM50035844

CC1(C)CCC[C@@H]1Nc1c(cnn2cccc12)C(N)=O |r|

BDBM50035845

NC(=O)c1cnn2cccc2c1NC1CCCC1

BDBM50035846

CC1(C)[C@@H](O)CC[C@H]1Nc1c(cnn2cccc12)C(N)=O |r|

BDBM50035847

CC1(C)[C@H](O)CC[C@H]1Nc1c(cnn2cccc12)C(N)=O |r|

BDBM50035848

C[C@]1(O)CC[C@@H](Nc2c(cnn3cccc23)C(N)=O)C1(C)C |r|

BDBM50035849

C[C@@]1(O)CC[C@@H](Nc2c(cnn3cccc23)C(N)=O)C1(C)C |r|

BDBM50035850

C[C@]1(O)C[C@@H](Nc2c(cnn3cccc23)C(N)=O)C(C)(C)C1 |r|

BDBM50035851

C[C@@]1(O)C[C@@H](Nc2c(cnn3cccc23)C(N)=O)C(C)(C)C1 |r|

BDBM50048357

c1cc2c(c(c1)F)c3nc(nn3c(n2)Cc4ccc5c(c4)OCO5)N

BDBM50048362

Nc1nc2c3ccc(N)cc3nc(Cc3ccc4OCOc4c3)n2n1

BDBM50048364

OCCCNc1ccc2c3ncnn3c(nc2c1)-c1ccc2OCOc2c1

BDBM50048365

c1cc2c(cc1Cc3nc4cc(ccc4c5n3nc(n5)N)NCCO)OCO2

BDBM50048374

CN1CCN(CC1)c1cc(F)c2c3nc(N)nn3c(Cc3ccc4OCOc4c3)nc2c1

BDBM50059654

Cc1ccc(cn1)-c1ncn(n1)-c1ccc(Nc2nccc(n2)-c2cccc(c2)N2CCOCC2)cc1

BDBM50175196

CC(=O)N1CCN(CC1)C2CCC(CC2)n3c4c(c(n3)c5ccc(c(c5)OC)NC(=O)c6cc7ccccc7n6C)c(ncn4)N

BDBM50084464

CN1CCN(CC1)c2ccc(cc2)Nc3ncc(c(n3)NC[C@H]4CCCO4)Cl

BDBM50094659

NC(=O)c1cc(cc2c3cc(ccc3[nH]c12)C(=O)N1CCOCC1)-c1ccc(Cl)c(Cl)c1

BDBM50094660

NC(=O)c1cc(cc2c1[nH]c1ccc(cc21)C(=O)N1CCOCC1)-c1ccccc1

BDBM50094661

COc1cccc(c1)-c1cc(C(N)=O)c2[nH]c3ccc(cc3c2c1)C(=O)N1CCOCC1

BDBM130283

NC(=O)c1cc(cc2c3cc(ccc3[nH]c12)C(=O)N1CCOCC1)-c1ccc(Cl)cc1Cl

BDBM50094664

CCCOc1cccc(c1)-c1cc(C(N)=O)c2[nH]c3ccc(cc3c2c1)C(=O)N1CCOCC1

BDBM130257

CN1CCN(CC1)C(=O)c1ccc2[nH]c3c(cc(cc3c2c1)-c1ccc(Cl)cc1)C(N)=O

BDBM50094609

CN(C)[C@H]1CCN(C1)C(=O)c1ccc2[nH]c3c(cc(cc3c2c1)-c1ccc(Cl)c(Cl)c1)C(N)=O |r|

BDBM50094612

COc1cccc(c1)-c1cc(C(N)=O)c2[nH]c3ccc(cc3c2c1)C(=O)N1CCN(C)CC1

BDBM50094658

NC(=O)c1cc(Cc2ccccc2)cc2c3cc(ccc3[nH]c12)C(=O)N1CCOCC1

BDBM50094657

NC(=O)c1cc(cc2c3CC(CCc3[nH]c12)C(=O)N1CCOCC1)-c1ccc(Cl)c(Cl)c1

BDBM50094656

NC(=O)c1cc(cc2c1[nH]c1cc(ccc21)C(=O)N1CCOCC1)-c1ccccc1

BDBM50094655

COc1cccc(c1)-c1cc(C(N)=O)c2[nH]c3cc(ccc3c2c1)C(=O)N1CCOCC1

BDBM130281

COc1ccc(cc1F)-c1cc(C(N)=O)c2[nH]c3cc(ccc3c2c1)C(=O)N1CCOCC1

BDBM50094624

COc1cccc(c1)-c1cc(C(N)=O)c2[nH]c3cc(ccc3c2c1)C(=O)N1CC[C@@H](C1)N(C)C |r|

BDBM50094620

COc1cccc(c1)-c1cc(C(N)=O)c2[nH]c3cc(NC(=O)C4CCOCC4)ccc3c2c1

BDBM50094617

NC(=O)c1cc(cc2c1[nH]c1cc(ccc21)N1CCOCC1)-c1ccccc1

BDBM50094616

CN1CCN(CC1)c1ccc2c(c1)[nH]c1c(cc(cc21)-c1ccccc1)C(N)=O

BDBM50094615

CN1CCN(CC1)c1ccc2c(c1)[nH]c1c(cc(cc21)-c1cccc(Cl)c1)C(N)=O

BDBM50094613

CN1CCN(CC1)c1ccc2c(c1)[nH]c1c(cc(cc21)-c1ccc(CN2CCOCC2)c(Cl)c1)C(N)=O

BDBM130337

Cc1ccc(cn1)-c1cc(C(N)=O)c2[nH]c3cc(ccc3c2c1)N1CCOCC1

BDBM50094665

CN1CCN(CC1)c1ccc2c(c1)[nH]c1c(cc(cc21)-c1ccc2n(C)ncc2c1)C(N)=O

BDBM50194671

CNc1ncc2cc(ccc2n1)-c1cc(ccc1C)C(=O)Nc1cc(ccc1OC1CCN(C)CC1)C(F)(F)F

BDBM50194668

Cc1ccc(cc1-c1ccc2nc(NCCN3CCOCC3)ncc2c1)C(=O)Nc1cccc(c1)C(F)(F)F

BDBM50109526

[H][C@]12CS[C@@H](CCCCC(=O)NCCOCCOCCOCCn3cc(Nc4ncc(Cl)c(NCc5cccc(NC(=O)C=C)c5)n4)cn3)[C@@]1([H])NC(=O)N2 |r|

BDBM50109527

OCCn1cc(Nc2ncc(Cl)c(NCc3cccc(NC(=O)C=C)c3)n2)cn1

BDBM50109528

COCCn1cc(Nc2ncc(Cl)c(NCc3cccc(NC(=O)C=C)c3)n2)cn1

BDBM50109532

CN1CCN(CC1)c2ccc(c(c2)OC)Nc3ncc(c(n3)NCc4cccc(c4)NC(=O)C=C)Cl

BDBM138348

c1c(cc(c2c1CN(C2=O)C3CCN(CC3)C4CCC(CC4)(F)F)C(=O)N)F

BDBM50117298

CC(C)c1nn(C)cc1-c1nc2c(N3CCN(Cc4cccnc4)CC3)c(Br)cnc2[nH]1

BDBM50121209

C(C1CO1)n1cc(nn1)-c1ncnc2[nH]ccc12

BDBM50121383

CCn1c(cc2c1nc(NC)c1ncn(C)c21)C(=O)N(C1CC1)C1CC1

BDBM50121378

CCn1c(cc2c1nc(Nc1nc(C)cs1)c1ncn(C)c21)C(=O)N(C1CC1)C1CC1

BDBM50121379

CCn1c(cc2c1nc(Nc1nccs1)c1ncn(C)c21)C(=O)N(C1CC1)C1CC1

BDBM50121391

CCn1c(cc2c1nc(c3c2n(cn3)C)Nc4nc(c(s4)C)C)C(=O)N(C5CC5)C6CC6

BDBM50121377

CCn1c(cc2c1nc(Nc1ncc(C)s1)c1ncn(C)c21)C(=O)N(C1CC1)C1CC1

BDBM50121382

CCn1c(cc2c1nc(c3c2n(cn3)C)NCCCOC)C(=O)N(C4CC4)C5CC5

BDBM50121380

CCn1c(cc2c1nc(NC(=O)NCCOC)c1ncn(C)c21)C(=O)N(C1CC1)C1CC1

BDBM50121381

CCn1c(cc2c1nc(NC(=O)OCCOC)c1ncn(C)c21)C(=O)N(C1CC1)C1CC1

BDBM50122319

CCn1c(cc2c1nc(Nc1cc(C)[nH]n1)c1ncn(C)c21)C(=O)N(C1CC1)C1CC1

BDBM50122320

CCn1c(cc2c1nc(Nc1cc(C)nn1C)c1ncn(C)c21)C(=O)N(C1CC1)C1CC1

BDBM50122321

CCn1nc(Nc2nc3n(CC)c(cc3c3n(C)cnc23)C(=O)N(C2CC2)C2CC2)cc1C

BDBM50122318

CCn1c(cc2c1nc(c3c2n(cn3)C)Nc4cc(n(n4)C)C)C(=O)N(C5CC5)C6CC6

BDBM50123455

CN1CCN(CC1)C(=O)c1ccc2c(c1)[nH]c1c(ccc(-c3ccccc3F)c21)C(N)=O

BDBM50123456

CN1CCN(CC1)C(=O)c1ccc2c(c1)[nH]c1c(ccc(-c3cccc(NC(C)=O)c3C)c21)C(N)=O

BDBM50123457

CN(C)c1ccc(cc1)C(=O)Nc1cccc(c1F)-c1ccc(C(N)=O)c2[nH]c3cc(ccc3c12)C(=O)N1CCN(C)CC1

BDBM50124147

NCCn1c(nc2cc(ccc12)C(N)=O)C1CCNCC1

BDBM50109821

CC(C)(C)c1nc2c([nH]1)c1cc[nH]c(=O)c1c1cc(F)ccc21

BDBM50124208

NC(=O)c1cnc2[nH]ccc2c1N[C@H]1[C@H]2CC3C[C@@H]1C[C@](O)(C3)C2 |r,TLB:17:16:23:13.18.19,THB:22:16:13:23.20.19|

BDBM50124207

NCCCn1c(CCN)nc2cc(ccc12)C(N)=O

BDBM50124206

NCCCn1c(nc2cc(ccc12)C(N)=O)-c1ccccc1

BDBM50124199

NCCc1nc2cc(ccc2n1CCN)C(N)=O

BDBM50124190

NCCCc1nc2cc(ccc2n1CCN)C(N)=O

BDBM50124154

NCCn1c(nc2cc(ccc12)C(N)=O)C1CCCCC1

BDBM50124153

NCCn1c(nc2cc(ccc12)C(N)=O)-c1ccccc1

BDBM50124152

NCCn1c(Cc2ccccc2)nc2cc(ccc12)C(N)=O

BDBM50124150

NCCn1c(nc2cc(ccc12)C(N)=O)-c1ccc(cc1)C#N

BDBM50124149

Cc1ccc(cc1)-c1nc2cc(ccc2n1CCN)C(N)=O

BDBM50124148

CC(C)c1ccc(cc1)-c1nc2cc(ccc2n1CCN)C(N)=O

BDBM50124209

NCCn1c(nc2cc(ccc12)C(N)=O)-c1ccc(cc1)C(F)(F)F

BDBM50124210

NCCn1c(nc2cc(ccc12)C(N)=O)-c1ccc(O)cc1

BDBM50124211

NCCn1c(nc2cc(ccc12)C(N)=O)-c1ccc(O)cc1O

BDBM50124212

NCCn1c(nc2cc(ccc12)C(N)=O)-c1ccncc1

BDBM50124213

NCCn1c(nc2cc(ccc12)C(N)=O)-c1cccnc1N

BDBM50124214

NCCn1c(nc2cc(ccc12)C(N)=O)-c1cncnc1

BDBM50273571

CCS(=O)(=O)Nc1ccc2c(c1)C(C(=O)N2)/C(=N/c3ccc(cc3)CN4CCCCC4)/c5ccccc5

BDBM50135125

COc1ccc(cc1OC)-c1nc2c(NCC3CCNCC3)c(Cl)cnc2[nH]1

BDBM50135128

COc1ccc(F)c(c1)-c1nc2c(NCC3CCNCC3)c(Cl)cnc2[nH]1

BDBM50135130

COc1cc(F)c(cc1OC)-c1nc2c(NCC3CCNCC3)c(Cl)cnc2[nH]1

BDBM50135286

Cn1c2nc(Nc3ccc4[nH]ccc4c3)ncc2cc(c1=O)S(=O)(=O)c1ccc(F)cc1F

BDBM50144963

COCCOc1cc2c(ncnc2cc1OC)-n1nc(nc1N)-c1ccccn1

BDBM50146024

CC(C)[C@@H](C)n1cc(-c2cc(n(C)n2)C(C)(C)O)c2[nH]nc(N)c2c1=O |r|

BDBM50146025

CC(C)[C@H](C)n1cc(-c2cc(N3CCS(=O)(=O)CC3)n(C)n2)c2[nH]nc(N)c2c1=O |r|

BDBM50146026

CC(C)[C@H](C)n1cc(-c2cc(C3CCOCC3)n(C)n2)c2[nH]nc(N)c2c1=O |r|

BDBM50146027

CC(C)[C@H](C)n1cc(-c2cc(N3CCOCC3)n(C)n2)c2[nH]nc(N)c2c1=O |r|

BDBM50146028

CC(C)[C@H](C)n1cc(-c2ccn(C)n2)c2[nH]nc(N)c2c1=O |r|

BDBM50146029

CC(C)[C@@H](C)n1cc(-c2ccc(cn2)N2CCOCC2)c2[nH]nc(N)c2c1=O |r|

BDBM50146030

CC(C)[C@H](C)n1cc(-c2ccc(cn2)N2CCOCC2)c2[nH]nc(N)c2c1=O |r|

BDBM50146031

CC(C)C(C)n1cc(-c2ccc(cn2)N2CCOCC2)c2[nH]nc(N)c2c1=O

BDBM50146032

CCC(C(C)C)n1cc(-c2ccn(C)n2)c2[nH]nc(N)c2c1=O

BDBM50146033

CC(C)Cn1cc(-c2ccn(C)n2)c2[nH]nc(N)c2c1=O

BDBM50146034

CCC(C)n1cc(-c2ccn(C)n2)c2[nH]nc(N)c2c1=O

BDBM50146035

CC(C)C(C)n1cc(-c2ccn(C)n2)c2[nH]nc(N)c2c1=O

BDBM50146036

Cc1ccccc1N2C=C(c3c(c(n[nH]3)N)C2=O)c4ccn(n4)C

BDBM50146037

Cc1ccccc1-n1cc(-c2ccccc2)c2[nH]nc(N)c2c1=O

BDBM50146071

Nc1n[nH]c2c(cn(-c3ccccc3Cl)c(=O)c12)-c1ccccn1

BDBM50146072

Cn1ccc(n1)-c1cn(-c2ccccc2Cl)c(=O)c2c(N)n[nH]c12

BDBM50146073

Nc1n[nH]c2ccn(-c3ccccc3Cl)c(=O)c12

BDBM50254869

Nc1n[nH]c2ccc(cc12)-c1ccccc1Cl

BDBM50146074

OC(=O)Cc1cnc(Nc2n[nH]c3ccc(cc23)-c2ncccc2Cl)s1

BDBM50152601

COC(=O)C1CCc2[nH]c(nc2C1)-c1c(N[C@@H]2CC[C@H](N)CC2)cc[nH]c1=O |r,wD:16.17,19.21,(-4.79,-3.68,;-3.72,-3.07,;-3.72,-1.53,;-4.78,-.91,;-2.38,-.77,;-2.38,.77,;-1.03,1.55,;.3,.77,;1.76,1.24,;2.66,.02,;1.76,-1.24,;.3,-.77,;-1.03,-1.55,;4.2,.03,;4.85,1.43,;3.98,2.69,;4.64,4.09,;3.76,5.35,;4.42,6.74,;5.96,6.87,;6.49,7.98,;6.83,5.6,;6.17,4.21,;6.39,1.55,;7.26,.28,;6.61,-1.11,;5.07,-1.23,;4.54,-2.35,)|

BDBM50152595

c1ccc2c(c1)[nH]c(n2)C3=C(C=CNC3=O)NC4CCC(CC4)N

BDBM50152596

O=c1[nH]ccc(NC2CCOCC2)c1-c1nc2ccccc2[nH]1

BDBM50152597

CS(=O)(=O)c1ccc(Nc2nn(cc2C(N)=O)C2CCOCC2)cc1

BDBM50157881

Nc1ncnc2n(cc(-c3cccc(OC[C@@H]4CCCO4)c3)c12)[C@@H]1C[C@H](CN2CCC2)C1 |r,wD:23.26,16.15,25.29,(-1.03,2.79,;-1.03,1.55,;-2.38,.77,;-2.38,-.77,;-1.03,-1.55,;.3,-.77,;1.76,-1.24,;2.66,.02,;1.76,1.24,;2.23,2.7,;3.76,2.91,;4.33,4.34,;3.38,5.55,;1.86,5.34,;.91,6.55,;1.49,7.98,;.54,9.2,;-.98,9.12,;-1.51,10.57,;-.3,11.52,;.98,10.66,;1.29,3.91,;.3,.77,;2.24,-2.7,;3.54,-3.45,;2.74,-4.76,;3.1,-6.25,;4.58,-6.69,;5.27,-8.02,;6.62,-7.28,;5.88,-5.93,;1.42,-3.96,)|

BDBM50157880

Nc1ncnc2n(cc(-c3cccc(O)c3)c12)[C@@H]1C[C@H](CN2CCC2)C1 |r,wD:17.19,19.22,(-1.03,2.79,;-1.03,1.55,;-2.38,.77,;-2.38,-.77,;-1.03,-1.55,;.3,-.77,;1.76,-1.24,;2.66,.02,;1.76,1.24,;2.23,2.7,;3.76,2.91,;4.33,4.34,;3.38,5.56,;1.86,5.34,;1.1,6.31,;1.29,3.91,;.3,.77,;2.24,-2.7,;3.54,-3.45,;2.74,-4.76,;3.1,-6.25,;4.58,-6.69,;5.27,-8.02,;6.62,-7.28,;5.88,-5.93,;1.42,-3.96,)|

BDBM50158429

Nc1ncnc2n(cc(-c3cccc(OCC45CCC(CC4)O5)c3)c12)[C@@H]1C[C@H](CN2CCC2)C1 |r,wD:25.29,27.32,(-1.03,2.79,;-1.03,1.55,;-2.38,.77,;-2.38,-.77,;-1.03,-1.55,;.3,-.77,;1.76,-1.24,;2.66,.02,;1.76,1.24,;2.23,2.7,;3.76,2.92,;4.34,4.35,;3.39,5.56,;1.86,5.34,;.91,6.56,;1.49,7.99,;.54,9.2,;-.78,8.6,;-1.87,9.66,;-1.5,11.15,;-.02,11.55,;1.07,10.5,;-.08,10.34,;1.29,3.91,;.3,.77,;2.24,-2.7,;3.54,-3.45,;2.74,-4.76,;3.1,-6.26,;4.58,-6.69,;5.27,-8.03,;6.62,-7.29,;5.88,-5.94,;1.42,-3.96,)|

BDBM50156383

CC(=O)N1CCN(CC1)[C@H]1C[C@H](C1)n1cc(-c2cc(OC[C@@H]3CCCO3)ccc2F)c2c(N)ncnc12 |r,wU:21.22,wD:11.14,9.9,(4.28,-11.46,;5,-10.46,;6.22,-10.59,;4.36,-9.06,;2.83,-8.9,;2.2,-7.5,;3.1,-6.26,;4.64,-6.41,;5.27,-7.81,;2.74,-4.76,;3.54,-3.45,;2.24,-2.7,;1.42,-3.96,;1.76,-1.24,;2.66,.02,;1.76,1.24,;2.23,2.7,;3.76,2.91,;4.33,4.34,;5.86,4.56,;6.43,5.99,;7.96,6.21,;9.01,5.1,;10.39,5.78,;10.17,7.31,;8.66,7.57,;3.38,5.55,;1.86,5.34,;1.29,3.91,;.07,3.74,;.3,.77,;-1.03,1.55,;-1.03,2.79,;-2.38,.77,;-2.38,-.77,;-1.03,-1.55,;.3,-.77,)|

BDBM50157628

CC(=O)N1CCN(CC1)[C@H]1C[C@H](C1)n1cc(-c2cccc(OC[C@@H]3CCCO3)c2F)c2c(N)ncnc12 |r,wD:11.14,23.24,9.9,(4.28,-11.46,;5,-10.46,;6.22,-10.59,;4.36,-9.06,;2.83,-8.9,;2.2,-7.5,;3.1,-6.26,;4.64,-6.41,;5.27,-7.81,;2.74,-4.76,;3.54,-3.45,;2.24,-2.7,;1.42,-3.96,;1.76,-1.24,;2.66,.02,;1.76,1.24,;2.23,2.7,;3.76,2.91,;4.33,4.34,;3.38,5.55,;1.86,5.34,;.91,6.55,;1.49,7.98,;.54,9.2,;-.98,9.12,;-1.51,10.57,;-.3,11.52,;.98,10.66,;1.29,3.91,;.07,3.74,;.3,.77,;-1.03,1.55,;-1.03,2.79,;-2.38,.77,;-2.38,-.77,;-1.03,-1.55,;.3,-.77,)|

BDBM50157879

[H][C@]1(CN2CCC2)C[C@]([H])(C1)n1cc(-c2cccc(OCc3ccccc3)c2)c2c(N)ncnc12 |wD:8.9,1.0,(6.47,-15.11,;5.71,-13.78,;4.93,-15.11,;5.69,-16.44,;5.68,-17.98,;7.22,-17.99,;7.23,-16.45,;5.31,-12.3,;6.81,-11.9,;6.02,-10.55,;7.2,-13.39,;7.59,-10.56,;6.61,-9.37,;7.45,-8.07,;7.04,-6.58,;5.56,-6.19,;5.15,-4.71,;6.24,-3.6,;7.73,-3.99,;8.81,-2.89,;10.15,-3.66,;11.48,-2.89,;12.81,-3.66,;14.12,-2.9,;14.13,-1.36,;12.8,-.59,;11.48,-1.36,;8.13,-5.47,;8.94,-8.47,;10.35,-7.7,;10.34,-6.15,;11.69,-8.46,;11.69,-10.01,;10.35,-10.79,;9.02,-10.01,)|

BDBM50178945

CNCCn1c(nc2cc(ccc12)C(N)=O)[C@H]1CC[C@H](O)CC1 |r,wU:16.17,wD:19.21,(5.43,4.73,;4.23,4.48,;3.75,3.01,;2.24,2.7,;1.76,1.24,;2.66,.02,;1.76,-1.24,;.3,-.77,;-1.03,-1.55,;-2.38,-.77,;-2.38,.77,;-1.03,1.55,;.3,.77,;-3.72,-1.53,;-3.73,-2.76,;-4.78,-.9,;4.2,.03,;4.85,1.43,;6.39,1.55,;7.26,.28,;8.49,.39,;6.61,-1.11,;5.07,-1.23,)|

BDBM50178946

C[C@@H](O)Cn1c(nc2cc(ccc12)C(N)=O)[C@H]1CC[C@H](O)CC1 |r,wU:16.17,wD:19.21,1.1,(4.57,2.1,;3.75,3.01,;4.13,4.18,;2.24,2.7,;1.76,1.24,;2.66,.02,;1.76,-1.24,;.3,-.77,;-1.03,-1.55,;-2.38,-.77,;-2.38,.77,;-1.03,1.55,;.3,.77,;-3.72,-1.53,;-3.73,-2.76,;-4.78,-.9,;4.2,.03,;4.85,1.43,;6.39,1.55,;7.26,.28,;8.49,.39,;6.61,-1.11,;5.07,-1.23,)|

BDBM50178947

NC(=O)c1ccc2n(CCCO)c(nc2c1)[C@H]1CC[C@H](O)CC1 |r,wU:16.17,wD:19.21,(-3.73,-2.76,;-3.72,-1.53,;-4.78,-.9,;-2.38,-.77,;-2.38,.77,;-1.03,1.55,;.3,.77,;1.76,1.23,;2.24,2.7,;3.75,3.01,;4.23,4.48,;5.43,4.73,;2.66,.02,;1.76,-1.23,;.3,-.77,;-1.03,-1.55,;4.2,.03,;4.85,1.42,;6.39,1.55,;7.26,.28,;8.49,.39,;6.6,-1.11,;5.07,-1.23,)|

BDBM50178948

NC(=O)c1ccc2n(CCO)c(nc2c1)[C@H]1CC[C@H](O)CC1 |r,wU:15.16,wD:18.20,(-3.73,-2.76,;-3.72,-1.53,;-4.78,-.9,;-2.38,-.77,;-2.38,.77,;-1.03,1.55,;.3,.77,;1.76,1.24,;2.24,2.7,;3.75,3.01,;4.13,4.18,;2.66,.02,;1.76,-1.24,;.3,-.77,;-1.03,-1.55,;4.2,.03,;4.85,1.43,;6.39,1.55,;7.26,.28,;8.49,.39,;6.61,-1.11,;5.07,-1.23,)|

BDBM50178949

NCCCn1c(nc2cc(ccc12)C(N)=O)C1CCNCC1

BDBM50178950

CNCCn1c(nc2cc(ccc12)C(N)=O)C1CCNCC1

BDBM50178951

NCCCn1c(nc2cc(ccc12)C(N)=O)[C@H]1CC[C@H](O)CC1 |r,wU:16.17,wD:19.21,(5.43,4.73,;4.23,4.48,;3.75,3.01,;2.24,2.7,;1.76,1.23,;2.66,.02,;1.76,-1.23,;.3,-.77,;-1.03,-1.55,;-2.38,-.77,;-2.38,.77,;-1.03,1.55,;.3,.77,;-3.72,-1.53,;-3.73,-2.76,;-4.78,-.9,;4.2,.03,;4.85,1.42,;6.39,1.55,;7.26,.28,;8.49,.39,;6.6,-1.11,;5.07,-1.23,)|

BDBM50182493

CN1C(=O)COc2c1cnc1ccc(Sc3nnc4c(F)cc(cn34)-c3cnn(C)c3)cc21

BDBM50191467

Nc1n[nH]c2ccc(cc12)C(=O)N1CCC[C@H]1c1ccc(Cl)cc1 |r|

BDBM50305006

NCCn1cc(-c2cc(-c3cc4ccccc4s3)c3[nH]ncc3c2)c2nc(N)ncc12

BDBM50208911

CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3ccccc3)ncc12 |r|

BDBM50210167

ONC(=O)CCCCCCOc1ccc2Nc3nccc(n3)-c3cccc(COC\C=C\COCc1c2)c3 |t:31|

BDBM50312974

COc1cc(Nc2nc3cccc(-c4ccccn4)c3o2)cc(OC)c1OC

BDBM50312975

COc1cc(Nc2nc3cccc(-c4ccccc4)c3o2)cc(OC)c1OC

BDBM50312976

COc1cc(Nc2nc3cccc(-c4cccc(Cl)c4)c3o2)cc(OC)c1OC

BDBM50312977

COc1ccc(cc1)-c1cccc2nc(Nc3cc(OC)c(OC)c(OC)c3)oc12

BDBM50312978

COc1cc(Nc2nc3cccc(-c4ccc5ncccc5c4)c3o2)cc(OC)c1OC

BDBM50312979

COc1cc(Nc2nc3cccc(-c4cccc(NS(C)(=O)=O)c4)c3o2)cc(OC)c1OC

BDBM50312980

COc1cc(Nc2nc3cccc(-c4ccc(NS(C)(=O)=O)cc4)c3o2)cc(OC)c1OC

BDBM50312981

COc1cc(Nc2nc3cccc(-c4ccc(cc4)C(=O)N4CCOCC4)c3o2)cc(OC)c1OC

BDBM50312982

COc1cc(Nc2nc3cccc(-c4ccc(C(=O)N5CCOCC5)c(F)c4)c3o2)cc(OC)c1OC

BDBM50312983

COc1cc(Nc2nc3cccc(-c4ccc(CN5CCOCC5)cc4)c3o2)cc(OC)c1OC

BDBM50312984

CN(C)C(=O)c1ccc(Nc2nc3cccc(-c4ccc(cc4)C(=O)N4CCOCC4)c3o2)cc1

BDBM50312986

CN(C)C(=O)c1ccc(Nc2nc3cccc(-c4cc(F)c(CN5CCOCC5)c(F)c4)c3o2)cc1C

BDBM50312987

CNC(=O)c1ccc(Nc2nc3cccc(-c4cc(F)c(CN5CCOCC5)c(F)c4)c3o2)cc1C

BDBM50312988

CN1CCN(CC1)c1ccc(Nc2nc3cccc(-c4ccc(C(=O)N5CCOCC5)c(C)c4)c3o2)cc1

BDBM50312989

CN(C)CCCNC(=O)c1ccc(Nc2nc3cccc(-c4cc(F)c(CN5CCOCC5)c(F)c4)c3o2)cc1C

BDBM50315232

COc1cc(cc(OC)c1OC)-c1cnc2cccc(-c3ccc(CN4CCOCC4)cc3F)c2n1

BDBM50315233

CN1CCN(CC1)C(=O)c1ccc(cc1C)-c1cnc2cccc(-c3ccc(CN4CCS(=O)(=O)CC4)cc3)c2n1

BDBM50315234

Cc1cc(ccc1CN1CCOCC1)-c1cccc2ncc(nc12)-c1ccc(C(=O)N2CCOCC2)c(C)c1

BDBM50315235

Cc1cc(ccc1C(=O)N1CCOCC1)-c1cnc2cccc(-c3ccc(CN4CCOCC4)c(F)c3)c2n1

BDBM50315236

Cc1cc(ccc1C(=O)N1CCOCC1)-c1cnc2cccc(-c3cc(F)c(CN4CCOCC4)c(F)c3)c2n1

BDBM50315237

CN1CCN(CC1)c1ccc(cc1)-c1cnc2cccc(-c3cc(F)c(CN4CCOCC4)c(F)c3)c2n1

BDBM50315238

CN1CCN(CC1)c1ccc(cn1)-c1cnc2cccc(-c3cc(F)c(CN4CCS(=O)(=O)CC4)c(F)c3)c2n1

BDBM50315231

Fc1cc(cc(F)c1CN1CCOCC1)-c1cccc2ncc(nc12)-c1cnn(c1)C1CCNCC1

BDBM50313807

CNS(=O)(=O)c1ccc(cc1)-c1cccc2ncc(nc12)-c1cc(OC)c(OC)c(OC)c1

BDBM50315239

COc1cc(cc(OC)c1OC)-c1cnc2cccc(-c3ccc(CC(=O)N4CCOCC4)cc3)c2n1

BDBM50315240

COc1cc(cc(OC)c1OC)-c1cnc2cccc(-c3ccc(CC(=O)N4CCS(=O)(=O)CC4)cc3)c2n1

BDBM50315241

COc1cc(cc(OC)c1OC)-c1cnc2cccc(-c3ccc(CN4CCS(=O)(=O)CC4)cc3)c2n1

BDBM50315242

COc1cc(cc(OC)c1OC)-c1cnc2cc(C)cc(-c3ccc(CC(=O)N4CCS(=O)(=O)CC4)cc3)c2n1

BDBM50315243

COc1cc(cc(OC)c1OC)-c1cnc2cc(F)cc(-c3ccc(CC(=O)N4CCOCC4)cc3)c2n1

BDBM50315244

COc1cc(cc(OC)c1OC)-c1cnc2cccc(-c3ccc(cc3)C(=O)N3CCOCC3)c2n1

BDBM50315245

COc1cc(cc(OC)c1OC)-c1cnc2cccc(-c3ccc(CN4CCOCC4)cc3)c2n1

BDBM50315246

COc1cc(cc(OC)c1OC)-c1cnc2cccc(-c3ccc(CN4CCOCC4)c(C)c3)c2n1

BDBM50315247

COc1cc(cc(OC)c1OC)-c1cnc2cccc(-c3ccc(C(=O)N4CCOCC4)c(C)c3)c2n1

BDBM50315248

COc1cc(cc(OC)c1OC)-c1cnc2cccc(-c3ccc(CN4CCOCC4)c(F)c3)c2n1

BDBM50315249

COc1cc(cc(OC)c1OC)-c1cnc2cccc(-c3ccc(CN4CCOCC4)cc3C)c2n1

BDBM50315888

O=C(Cc1ccccc1)Nc1cccc(c1)-c1nc2sccn2c1-c1ccnc(Nc2cccc(c2)N2CCOCC2)n1

BDBM50331629

Cc1ccc(cc1NC(=O)c1cnn(c1N)-c1ccccc1F)C(=O)Nc1ccon1

BDBM50335376

COc1cc(O)c2c(CCCCCC(=O)C=CC[C@H](C)OC2=O)c1 |r,w:16.16|

BDBM50343559

CN1CCN(CC1)c1ccc(OC(F)(F)F)c(Nc2ncc3CCc4c(nn(CCO)c4-c3n2)C(N)=O)c1

BDBM50355403

Fc1ccc2c3[nH]c(nc3c3cc[nH]c(=O)c3c2c1)-c1ccccc1Cl

BDBM50361828

NC(=O)c1cnc(N)c2cc(sc12)-c1ccc(cc1)N1CCOCC1

BDBM50361829

CNC(=O)c1cnc(N)c2cc(sc12)-c1ccc(cc1)N1CCOCC1

BDBM50361830

CCNC(=O)c1cnc(N)c2cc(sc12)-c1ccc(cc1)N1CCOCC1

BDBM50361831

Nc1ncc(C(=O)Nc2ccccc2)c2sc(cc12)-c1ccc(cc1)N1CCOCC1

BDBM50361832

Nc1ncc(C(=O)NCc2ccccc2)c2sc(cc12)-c1ccc(cc1)N1CCOCC1

BDBM50361833

CC(C)(C)NC(=O)c1cnc(N)c2cc(sc12)-c1ccc(cc1)N1CCOCC1

BDBM50361834

CN(C)C(=O)c1cnc(N)c2cc(sc12)-c1ccc(cc1)N1CCOCC1

BDBM50361816

CNC(=O)c1cnc(N)c2cc(sc12)-c1ccccc1

BDBM50361817

CNC(=O)c1cnc(N)c2cc(sc12)-c1ccc(C)cc1

BDBM50361818

CNC(=O)c1cnc(N)c2cc(sc12)-c1ccc(cc1)C(C)(C)C

BDBM50361819

CNC(=O)c1cnc(N)c2cc(sc12)-c1ccc(OC(F)(F)F)cc1

BDBM50361820

CNC(=O)c1cnc(N)c2cc(sc12)-c1ccc(cc1)C(C)(C)C#N

BDBM50361821

CNC(=O)c1cnc(N)c2cc(sc12)-c1ccc(cc1)S(=O)(=O)NC(C)(C)C

BDBM50361822

CC(C)(C)NS(=O)(=O)c1ccc(cc1)-c1cc2c(N)ncc(C(=O)NCCO)c2s1

BDBM50361823

COCCNC(=O)c1cnc(N)c2cc(sc12)-c1ccc(cc1)S(=O)(=O)NC(C)(C)C

BDBM50361824

CN(C)CCNC(=O)c1cnc(N)c2cc(sc12)-c1ccc(cc1)S(=O)(=O)NC(C)(C)C

BDBM50361825

CC(C)(C)NS(=O)(=O)c1ccc(cc1)-c1cc2c(N)ncc(C(=O)NCCN3CCCCC3)c2s1

BDBM50361826

CC(C)(C)NS(=O)(=O)c1ccc(cc1)-c1cc2c(N)ncc(C(=O)NCCN3CCOCC3)c2s1

BDBM50361827

CC(C)(C)NS(=O)(=O)c1ccc(cc1)-c1cc2c(N)ncc(C(=O)NCCCN3CCOCC3)c2s1

BDBM50363167

Cn1c2c(C(C#N)C3(CCNCC3)NC2=O)c2ccc(Cl)c(Cl)c12

BDBM139694

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCc2[nH]1)C(=O)c1cnc(cn1)N1CCCCC1

BDBM50234907

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)C(=O)Nc1ccc(C)nc1

BDBM50234912

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc2CCN(C)Cc2[nH]1

BDBM50234908

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc2CCN(Cc2[nH]1)C(C)=O

BDBM50234909

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc2CCN(Cc2[nH]1)S(C)(=O)=O

BDBM50234910

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CCN(Cc3ccccc3)Cc2[nH]1

BDBM139691

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2CN(CCc2[nH]1)C(=O)c1ccc(F)cc1

BDBM50234898

C[C@@H]1CCN(C[C@@H]1N(C)c2c3cc[nH]c3ncn2)C(=O)N4CCCC4

BDBM50234899

C[C@@H]1CCN(C[C@@H]1N(C)c1ncnc2[nH]ccc12)C(=O)N1CC[C@H](C1)S(=O)(=O)c1cccc(O)c1 |r|

BDBM50234911

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc2ccccc2[nH]1

BDBM50234900

Oc1cccc(c1)-c1ccc2c(n[nH]c2c1)-c1nc2ccccc2[nH]1

BDBM50234901

CC(C)c1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc2ccccc2[nH]1

BDBM50234914

CCCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc2ccccc2[nH]1

BDBM50234902

COc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1nc2ccccc2[nH]1

BDBM50234903

CCc1cc(O)c(F)cc1-c1ccc2c(n[nH]c2c1)-c1nc2ccccc2[nH]1

BDBM50234904

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)-c1ncc[nH]1

BDBM50234913

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)C(N)=O

BDBM50234905

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)C(=O)NC

BDBM50234906

CCc1cc(O)ccc1-c1ccc2c(n[nH]c2c1)C(=O)N(C)C

BDBM50243810

CN(CC1CC1)S(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:12.15,10.10,(14.93,-10.76,;14.93,-12.3,;16.27,-13.08,;17.6,-12.32,;19.14,-12.32,;18.38,-10.98,;13.59,-13.07,;14.35,-14.4,;12.82,-14.39,;12.26,-12.31,;10.93,-13.08,;9.44,-12.69,;9.05,-14.18,;10.53,-14.57,;7.72,-14.96,;6.38,-14.19,;7.72,-16.5,;6.39,-17.27,;6.39,-18.81,;7.72,-19.58,;9.06,-18.8,;10.53,-19.27,;11.43,-18.02,;10.52,-16.78,;9.06,-17.26,)|

BDBM50243869

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)c1ccccc1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(4.65,-10.97,;5.99,-11.74,;7.32,-10.96,;7.71,-9.46,;9.2,-9.86,;8.81,-11.35,;10.53,-9.08,;11.86,-9.85,;12.62,-11.18,;11.09,-11.17,;13.2,-9.08,;14.53,-9.85,;15.86,-9.08,;15.86,-7.53,;14.51,-6.77,;13.19,-7.55,;5.99,-13.28,;4.66,-14.05,;4.66,-15.59,;6,-16.36,;7.34,-15.58,;8.81,-16.05,;9.71,-14.8,;8.79,-13.55,;7.33,-14.04,)|

BDBM50243850

CN(c1c2cc[nH]c2ncn1)C3CC(C3)NS(=O)(=O)C

BDBM50243851

CCS(=O)(=O)N[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:8.10,6.5,(13.65,-10.72,;12.32,-9.95,;10.98,-10.72,;11.74,-12.05,;10.21,-12.04,;9.65,-9.96,;8.32,-10.73,;6.83,-10.34,;6.44,-11.83,;7.93,-12.22,;5.11,-12.61,;3.77,-11.84,;5.11,-14.15,;3.78,-14.92,;3.78,-16.46,;5.12,-17.23,;6.46,-16.45,;7.93,-16.92,;8.83,-15.67,;7.91,-14.42,;6.45,-14.91,)|

BDBM50243852

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)c1ccc(F)cc1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(6.1,-10.71,;7.44,-11.48,;8.77,-10.7,;9.16,-9.21,;10.65,-9.6,;10.25,-11.09,;11.98,-8.83,;13.3,-9.59,;14.06,-10.92,;12.53,-10.91,;14.64,-8.82,;15.97,-9.6,;17.31,-8.83,;17.31,-7.29,;18.64,-6.52,;15.97,-6.52,;14.64,-7.29,;7.44,-13.01,;6.12,-13.78,;6.11,-15.33,;7.45,-16.1,;8.79,-15.32,;10.25,-15.78,;11.15,-14.53,;10.24,-13.29,;8.78,-13.78,)|

BDBM50243855

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)Cc1ccccc1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(6.11,-10.73,;7.45,-11.49,;8.78,-10.72,;9.17,-9.22,;10.66,-9.62,;10.27,-11.11,;11.99,-8.84,;13.32,-9.61,;14.09,-10.94,;12.55,-10.93,;14.66,-8.84,;15.99,-9.61,;15.98,-11.15,;17.31,-11.92,;18.65,-11.15,;18.65,-9.6,;17.32,-8.84,;7.45,-13.03,;6.13,-13.81,;6.12,-15.35,;7.46,-16.12,;8.8,-15.34,;10.27,-15.81,;11.17,-14.56,;10.25,-13.31,;8.79,-13.8,)|

BDBM50243856

CCCNS(=O)(=O)N[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:10.12,8.7,(18.66,-9.61,;17.33,-8.84,;15.99,-9.61,;14.66,-8.84,;13.32,-9.61,;14.09,-10.94,;12.55,-10.93,;11.99,-8.84,;10.66,-9.62,;9.17,-9.22,;8.78,-10.72,;10.27,-11.11,;7.45,-11.49,;6.11,-10.73,;7.45,-13.03,;6.13,-13.81,;6.12,-15.35,;7.46,-16.12,;8.8,-15.34,;10.27,-15.81,;11.17,-14.56,;10.25,-13.31,;8.79,-13.8,)|

BDBM50243871

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)NCCCC#N)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(6.11,-10.73,;7.45,-11.49,;8.78,-10.72,;9.17,-9.22,;10.66,-9.62,;10.27,-11.11,;11.99,-8.84,;13.32,-9.61,;14.09,-10.94,;12.55,-10.93,;14.66,-8.84,;15.99,-9.61,;17.33,-8.84,;18.66,-9.61,;20,-8.85,;21.33,-8.08,;7.45,-13.03,;6.13,-13.81,;6.12,-15.35,;7.46,-16.12,;8.8,-15.34,;10.27,-15.81,;11.17,-14.56,;10.25,-13.31,;8.79,-13.8,)|

BDBM50243898

CN([C@@H]1C[C@H](CS(=O)(=O)C2CC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(6.1,-10.71,;7.44,-11.48,;8.77,-10.7,;9.16,-9.21,;10.65,-9.6,;11.97,-8.83,;13.3,-9.59,;14.06,-10.92,;12.53,-10.91,;14.64,-8.82,;16.18,-8.82,;15.41,-7.49,;10.25,-11.09,;7.44,-13.01,;6.12,-13.78,;6.11,-15.32,;7.45,-16.09,;8.78,-15.32,;10.25,-15.78,;11.15,-14.53,;10.24,-13.29,;8.78,-13.78,)|

BDBM50243858

CCCS(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:9.11,7.6,(17.33,-8.84,;15.99,-9.61,;14.66,-8.84,;13.32,-9.61,;14.09,-10.94,;12.55,-10.93,;11.99,-8.84,;10.66,-9.62,;9.17,-9.22,;8.78,-10.72,;10.27,-11.11,;7.45,-11.49,;6.11,-10.73,;7.45,-13.03,;6.13,-13.81,;6.12,-15.35,;7.46,-16.12,;8.8,-15.34,;10.27,-15.81,;11.17,-14.56,;10.25,-13.31,;8.79,-13.8,)|

BDBM50243899

CCNS(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:9.11,7.6,(17.56,-10.65,;16.23,-11.42,;14.89,-10.65,;13.56,-11.42,;14.32,-12.75,;12.79,-12.74,;12.23,-10.66,;10.9,-11.43,;9.41,-11.04,;9.01,-12.53,;10.5,-12.92,;7.68,-13.31,;6.35,-12.54,;7.69,-14.85,;6.36,-15.62,;6.36,-17.16,;7.69,-17.93,;9.03,-17.15,;10.5,-17.62,;11.4,-16.37,;10.49,-15.13,;9.02,-15.61,)|

BDBM50243902

CCCNS(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:10.12,8.7,(18.89,-11.43,;17.56,-10.65,;16.23,-11.42,;14.89,-10.65,;13.56,-11.42,;14.32,-12.75,;12.79,-12.74,;12.23,-10.66,;10.9,-11.43,;9.41,-11.04,;9.01,-12.53,;10.5,-12.92,;7.68,-13.31,;6.35,-12.54,;7.69,-14.85,;6.36,-15.62,;6.36,-17.16,;7.69,-17.93,;9.03,-17.15,;10.5,-17.62,;11.4,-16.37,;10.49,-15.13,;9.02,-15.61,)|

BDBM50243909

CN([C@@H]1C[C@H](CS(=O)(=O)NCC2CC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(6.35,-12.54,;7.68,-13.31,;9.01,-12.53,;9.41,-11.04,;10.9,-11.43,;12.23,-10.66,;13.56,-11.42,;14.32,-12.75,;12.79,-12.74,;14.89,-10.65,;16.23,-11.42,;17.56,-10.65,;19.1,-10.65,;18.33,-9.31,;10.5,-12.92,;7.69,-14.85,;6.36,-15.62,;6.36,-17.16,;7.69,-17.93,;9.03,-17.15,;10.5,-17.62,;11.4,-16.37,;10.49,-15.13,;9.02,-15.61,)|

BDBM50243847

CCCS(=O)(=O)N[C@H]1C[C@@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wU:7.6,wD:9.11,(18.67,-11.52,;17.33,-12.28,;16,-11.51,;14.66,-12.28,;15.42,-13.61,;13.89,-13.61,;13.33,-11.52,;12,-12.29,;11.61,-13.78,;10.12,-13.4,;10.51,-11.9,;8.79,-14.17,;7.45,-13.4,;8.79,-15.71,;7.46,-16.48,;7.46,-18.02,;8.8,-18.8,;10.14,-18.02,;11.61,-18.48,;12.51,-17.23,;11.59,-15.99,;10.13,-16.47,)|

BDBM50243812

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)C1CC1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(5.58,-12.63,;6.92,-13.39,;8.25,-12.62,;8.64,-11.13,;10.12,-11.52,;9.73,-13.01,;11.45,-10.75,;12.78,-11.51,;13.54,-12.83,;12.01,-12.83,;14.12,-10.74,;15.66,-10.74,;14.89,-9.4,;6.92,-14.93,;5.6,-15.7,;5.59,-17.24,;6.93,-18.01,;8.26,-17.23,;9.73,-17.7,;10.63,-16.45,;9.72,-15.21,;8.25,-15.69,)|

BDBM50243813

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)CC1CCC1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(5.93,-12.31,;7.26,-13.07,;8.6,-12.3,;8.99,-10.8,;10.48,-11.2,;10.08,-12.69,;11.81,-10.42,;13.14,-11.19,;13.9,-12.52,;12.37,-12.51,;14.48,-10.42,;15.81,-11.19,;16.2,-12.67,;17.69,-12.28,;17.29,-10.79,;7.27,-14.61,;5.94,-15.39,;5.94,-16.93,;7.27,-17.7,;8.61,-16.92,;10.08,-17.39,;10.98,-16.14,;10.07,-14.89,;8.6,-15.38,)|

BDBM50243904

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)CCC(F)(F)F)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(7.09,-13.36,;8.42,-14.12,;9.75,-13.35,;10.15,-11.85,;11.64,-12.25,;11.24,-13.74,;12.97,-11.47,;14.3,-12.23,;15.06,-13.56,;13.52,-13.56,;15.63,-11.46,;16.97,-12.24,;18.3,-11.47,;19.63,-12.24,;18.3,-9.93,;19.63,-10.69,;8.43,-15.66,;7.1,-16.43,;7.1,-17.98,;8.43,-18.75,;9.77,-17.97,;11.24,-18.44,;12.14,-17.18,;11.23,-15.94,;9.76,-16.43,)|

BDBM50243838

COCCS(=O)(=O)N[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:10.12,8.7,(19.05,-9.69,;17.72,-8.92,;16.38,-9.69,;15.05,-8.91,;13.71,-9.68,;14.47,-11.01,;12.94,-11.01,;12.38,-8.92,;11.05,-9.7,;9.56,-9.3,;9.17,-10.8,;10.66,-11.18,;7.84,-11.57,;6.5,-10.81,;7.84,-13.11,;6.51,-13.88,;6.51,-15.43,;7.85,-16.2,;9.19,-15.42,;10.66,-15.89,;11.56,-14.63,;10.64,-13.39,;9.18,-13.88,)|

BDBM50243905

COCCCS(=O)(=O)N[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:11.13,9.8,(20.38,-8.92,;19.05,-9.69,;17.72,-8.92,;16.38,-9.69,;15.05,-8.91,;13.71,-9.68,;14.47,-11.01,;12.94,-11.01,;12.38,-8.92,;11.05,-9.7,;9.56,-9.3,;9.17,-10.8,;10.66,-11.18,;7.84,-11.57,;6.5,-10.81,;7.84,-13.11,;6.51,-13.88,;6.51,-15.43,;7.85,-16.2,;9.19,-15.42,;10.66,-15.89,;11.56,-14.63,;10.64,-13.39,;9.18,-13.88,)|

BDBM50243839

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)CCCC#N)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(6.15,-11.79,;7.49,-12.56,;8.82,-11.79,;9.21,-10.29,;10.7,-10.68,;10.31,-12.17,;12.03,-9.91,;13.36,-10.67,;14.12,-12,;12.59,-12,;14.7,-9.9,;16.03,-10.67,;17.37,-9.91,;18.7,-10.68,;20.03,-11.45,;7.49,-14.1,;6.17,-14.87,;6.16,-16.42,;7.5,-17.19,;8.84,-16.41,;10.31,-16.87,;11.21,-15.62,;10.29,-14.38,;8.83,-14.86,)|

BDBM50243840

CCN(C)S(=O)(=O)N[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:10.12,8.7,(14.58,-6.2,;13.25,-6.97,;13.25,-8.51,;14.58,-9.28,;11.91,-9.28,;12.67,-10.61,;11.14,-10.6,;10.58,-8.52,;9.25,-9.29,;7.76,-8.9,;7.37,-10.39,;8.85,-10.78,;6.03,-11.17,;4.7,-10.4,;6.04,-12.71,;4.71,-13.48,;4.71,-15.02,;6.04,-15.79,;7.38,-15.01,;8.85,-15.48,;9.75,-14.23,;8.84,-12.99,;7.37,-13.47,)|

BDBM50243906

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)N(C)C1CC1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(5.8,-11.92,;7.14,-12.68,;8.47,-11.91,;8.86,-10.41,;10.35,-10.81,;9.96,-12.3,;11.68,-10.03,;13.01,-10.8,;13.77,-12.13,;12.24,-12.12,;14.35,-10.03,;15.68,-10.8,;14.35,-8.49,;15.13,-7.16,;13.59,-7.16,;7.14,-14.22,;5.81,-15,;5.81,-16.54,;7.15,-17.31,;8.49,-16.53,;9.96,-17,;10.86,-15.75,;9.94,-14.5,;8.48,-14.99,)|

BDBM50243841

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)N1CCCCC1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(6.14,-13.71,;7.47,-14.47,;8.8,-13.7,;9.19,-12.21,;10.68,-12.6,;10.28,-14.09,;12.01,-11.83,;13.33,-12.59,;14.09,-13.91,;12.56,-13.91,;14.67,-11.82,;16.01,-12.6,;17.34,-11.84,;17.35,-10.3,;16.02,-9.52,;14.67,-10.28,;7.47,-16.01,;6.15,-16.78,;6.15,-18.32,;7.48,-19.09,;8.82,-18.31,;10.28,-18.78,;11.18,-17.53,;10.27,-16.29,;8.81,-16.77,)|

BDBM50243843

CN([C@@H]1C[C@H](CS(=O)(=O)N2CCCC2)C1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.4,(7.12,-14.17,;8.45,-14.94,;9.78,-14.17,;10.18,-12.67,;11.66,-13.06,;12.99,-12.29,;14.32,-13.05,;15.08,-14.38,;13.55,-14.37,;15.65,-12.28,;17.06,-12.91,;18.09,-11.77,;17.32,-10.43,;15.82,-10.75,;11.27,-14.55,;8.46,-16.48,;7.13,-17.24,;7.13,-18.79,;8.46,-19.56,;9.8,-18.78,;11.27,-19.24,;12.17,-17.99,;11.25,-16.75,;9.79,-17.24,)|

BDBM50243870

CCNS(=O)(=O)N[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:9.11,7.6,(17.33,-8.84,;15.99,-9.61,;14.66,-8.84,;13.32,-9.61,;14.09,-10.94,;12.55,-10.93,;11.99,-8.84,;10.66,-9.62,;9.17,-9.22,;8.78,-10.72,;10.27,-11.11,;7.45,-11.49,;6.11,-10.73,;7.45,-13.03,;6.13,-13.81,;6.12,-15.35,;7.46,-16.12,;8.8,-15.34,;10.27,-15.81,;11.17,-14.56,;10.25,-13.31,;8.79,-13.8,)|

BDBM50243857

CCS(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:8.10,6.5,(15.99,-9.61,;14.66,-8.84,;13.32,-9.61,;14.09,-10.94,;12.55,-10.93,;11.99,-8.84,;10.66,-9.62,;9.17,-9.22,;8.78,-10.72,;10.27,-11.11,;7.45,-11.49,;6.11,-10.73,;7.45,-13.03,;6.13,-13.81,;6.12,-15.35,;7.46,-16.12,;8.8,-15.34,;10.27,-15.81,;11.17,-14.56,;10.25,-13.31,;8.79,-13.8,)|

BDBM50243903

CCCCNS(=O)(=O)C[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:11.13,9.8,(20.23,-10.66,;18.89,-11.43,;17.56,-10.65,;16.23,-11.42,;14.89,-10.65,;13.56,-11.42,;14.32,-12.75,;12.79,-12.74,;12.23,-10.66,;10.9,-11.43,;9.41,-11.04,;9.01,-12.53,;10.5,-12.92,;7.68,-13.31,;6.35,-12.54,;7.69,-14.85,;6.36,-15.62,;6.36,-17.16,;7.69,-17.93,;9.03,-17.15,;10.5,-17.62,;11.4,-16.37,;10.49,-15.13,;9.02,-15.61,)|

BDBM50243811

CCCCS(=O)(=O)N[C@H]1C[C@H](C1)N(C)c1ncnc2[nH]ccc12 |r,wD:10.12,8.7,(18.14,-11.53,;16.81,-10.76,;15.47,-11.53,;14.14,-10.76,;12.8,-11.53,;13.56,-12.86,;12.03,-12.85,;11.47,-10.77,;10.14,-11.54,;8.65,-11.14,;8.26,-12.64,;9.75,-13.03,;6.93,-13.42,;5.59,-12.65,;6.93,-14.96,;5.61,-15.73,;5.6,-17.27,;6.94,-18.04,;8.28,-17.26,;9.75,-17.73,;10.65,-16.48,;9.73,-15.23,;8.27,-15.72,)|

BDBM50243837

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)CCCC(F)(F)F)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(6.04,-12.03,;7.37,-12.79,;8.7,-12.02,;9.1,-10.52,;10.58,-10.92,;10.19,-12.41,;11.92,-10.14,;13.24,-10.9,;14.01,-12.23,;12.47,-12.23,;14.58,-10.13,;15.92,-10.91,;17.25,-10.14,;18.58,-10.91,;19.92,-10.14,;18.58,-12.45,;19.91,-11.68,;7.38,-14.33,;6.05,-15.1,;6.05,-16.65,;7.38,-17.42,;8.72,-16.64,;10.19,-17.11,;11.09,-15.85,;10.18,-14.61,;8.71,-15.1,)|

BDBM50243907

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)NC1CC1)c1ncnc2[nH]ccc12 |r,wD:2.1,4.6,(6.11,-10.73,;7.45,-11.49,;8.78,-10.72,;9.17,-9.22,;10.66,-9.62,;10.27,-11.11,;11.99,-8.84,;13.32,-9.61,;14.09,-10.94,;12.55,-10.93,;14.66,-8.84,;15.99,-9.61,;16.76,-10.94,;17.54,-9.61,;7.45,-13.03,;6.13,-13.81,;6.12,-15.35,;7.46,-16.12,;8.8,-15.34,;10.27,-15.81,;11.17,-14.56,;10.25,-13.31,;8.79,-13.8,)|

BDBM50250136

CC(CCCCCC(=O)NO)n1cc(cn1)-c1ncnc2[nH]ccc12

BDBM50250135

ONC(=O)CCCCCCn1cc(cn1)-c1ncnc2[nH]ccc12

BDBM147798

CN(C)[C@H]1CC[C@@H]([C@H](C1)C#N)n1cc(C(N)=O)c(Nc2ccc(Cl)cc2)n1 |r|

BDBM237902

NC(=O)c1cn(nc1Nc1ccccc1)[C@H]1COCC[C@@H]1C#N |r|

BDBM237869

NC(=O)c1cn(nc1Nc1ccc(Cl)cc1)[C@H]1COCC[C@@H]1C#N |r|

BDBM50250933

NC(=O)c1cn(nc1Nc1ccc(cc1)C1CC1)[C@H]1COCC[C@@H]1C#N |r|

BDBM50250919

NC(=O)c1cn(nc1Nc1ccc(OC(F)F)cc1)[C@H]1COCC[C@@H]1C#N |r|

BDBM50250920

Cn1cc(cn1)-c1ccc(Nc2nn(cc2C(N)=O)[C@H]2COCC[C@@H]2C#N)cc1 |r|

BDBM237866

NC(=O)c1cn(nc1Nc1ccnc(F)c1)[C@H]1COCC[C@@H]1C#N |r|

BDBM237874

NC(=O)c1cn(nc1Nc1ccc(cc1)[C@H](O)C(F)(F)F)[C@H]1COCC[C@@H]1C#N |r|

BDBM50250934

C[C@@H]1NS(=O)(=O)c2ccc(Nc3nn(cc3C(N)=O)[C@H]3COCC[C@@H]3C#N)cc12 |r|

BDBM50250923

COc1cc(Nc2nn(cc2C(N)=O)[C@H]2COCC[C@@H]2C#N)ccc1C#N |r|

BDBM50250924

NC(=O)c1cn(nc1Nc1ccc(C#N)c(c1)C1CC1)[C@H]1COCC[C@@H]1C#N |r|

BDBM50250935

NC(=O)c1cn(nc1Nc1ccc(C#N)c(Cl)c1)[C@H]1COCC[C@@H]1C#N |r|

BDBM50250927

COc1cc(ccc1Cl)Nc2c(cn(n2)[C@H]3COCC[C@@H]3C#N)C(=O)N

BDBM50250928

CN(C)c1cc(Nc2nn(cc2C(N)=O)[C@H]2COCC[C@@H]2C#N)cc(F)n1 |r|

BDBM50250938

COc1ccnc2c(F)cc(Nc3nn(cc3C(N)=O)[C@H]3COCC[C@@H]3C#N)cc12 |r|

BDBM50250930

NC(=O)c1cn(nc1Nc1cc(F)c2nccc(Cl)c2c1)[C@H]1COCC[C@@H]1C#N |r|

BDBM50250918

NC(=O)c1cn(nc1Nc1ccc(F)cc1)[C@H]1COCC[C@@H]1C#N |r|

BDBM50250922

NC(=O)c1cn(nc1Nc1ccc(cc1)-n1ccnn1)[C@H]1COCC[C@@H]1C#N |r|

BDBM237900

NC(=O)c1cn(nc1Nc1ccc(cc1)C#N)[C@H]1COCC[C@@H]1C#N |r|

BDBM50250925

NC(=O)c1cn(nc1Nc1ccc(C#N)c(c1)C#N)[C@H]1COCC[C@@H]1C#N |r|

BDBM50250929

COc1cc(Nc2nn(cc2C(N)=O)[C@H]2COCC[C@@H]2C#N)cc(F)n1 |r|

BDBM50250931

Cc1ncnc2ccc(Nc3nn(cc3C(N)=O)[C@H]3COCC[C@@H]3C#N)cc12 |r|

BDBM50261256

CNc1cc(Nc2nccc3nc([nH]c23)-c2c(Cl)cccc2Cl)ncn1

BDBM50261255

Nc1cc(Nc2nccc3nc([nH]c23)-c2c(Cl)cccc2Cl)ncn1

BDBM50261216

Clc1cccc(Cl)c1-c1ccc2cnc(NC(=O)C3CC3)cc2c1

BDBM50261217

Clc1cccc(Cl)c1-c1ccc2c(NC(=O)C3CC3)nccc2c1

BDBM50261218

Clc1cccc(Cl)c1-c1nc2ccnc(NC(=O)C3CC3)c2[nH]1

BDBM50261219

Cn1c(nc2c(NC(=O)C3CC3)nccc12)-c1c(Cl)cccc1Cl |(33.14,-31.28,;32.7,-29.81,;33.64,-28.59,;32.77,-27.32,;31.29,-27.76,;29.98,-26.95,;30.02,-25.41,;28.7,-24.61,;28.74,-23.07,;27.35,-25.34,;26.55,-26.66,;25.81,-25.3,;28.62,-27.69,;28.58,-29.23,;29.9,-30.03,;31.25,-29.29,;35.18,-28.63,;35.91,-29.98,;35.11,-31.29,;37.45,-30.02,;38.26,-28.7,;37.52,-27.35,;35.98,-27.31,;35.25,-25.96,)|

BDBM50261220

Cn1c(nc2ccnc(NC(=O)C3CC3)c12)-c1c(Cl)cccc1Cl |(32.02,-38.74,;31.5,-40.19,;32.37,-41.46,;31.43,-42.68,;29.98,-42.16,;28.63,-42.89,;27.31,-42.09,;27.36,-40.55,;28.71,-39.82,;28.76,-38.28,;27.45,-37.47,;27.49,-35.93,;26.09,-38.2,;25.28,-39.51,;24.55,-38.16,;30.02,-40.62,;33.91,-41.51,;34.64,-42.86,;33.83,-44.17,;36.18,-42.91,;36.99,-41.59,;36.26,-40.24,;34.72,-40.19,;33.99,-38.84,)|

BDBM50261221

Clc1cccc(Cl)c1-c1nc2c(NC(=O)C3CC3)nccc2o1

BDBM50261222

Clc1cccc(Cl)c1-c1cc2ccnc(NC(=O)C3CC3)c2o1

BDBM50261253

Clc1cccc(Cl)c1-n1cc2c(NC(=O)C3CC3)nccc2n1

BDBM50261254

Clc1cccc(Cl)c1-c1nc2ccnc(Nc3ccncn3)c2[nH]1

BDBM50261276

Nc1cc(Nc2nccc3nc([nH]c23)-c2c(Cl)cc(cc2Cl)C#N)ncn1

BDBM50261260

CN(C)c1cc(Nc2nccc3nc([nH]c23)-c2c(Cl)cccc2Cl)ncn1

BDBM50261261

Clc1cccc(Cl)c1-c1nc2ccnc(Nc3cc(ncn3)N3CCCC3)c2[nH]1

BDBM50261262

OC1CCN(CC1)c1cc(Nc2nccc3nc([nH]c23)-c2c(Cl)cccc2Cl)ncn1

BDBM50261269

Clc1cccc(Cl)c1-c1nc2ccnc(Nc3cc(ccn3)C#N)c2[nH]1

BDBM50261268

Cc1cc(Nc2nccc3nc([nH]c23)-c2c(Cl)cccc2Cl)ncn1

BDBM50261257

COc1cc(Nc2nccc3nc([nH]c23)-c2c(Cl)cccc2Cl)ncn1

BDBM50261270

Clc1cccc(Cl)c1-c1nc2ccnc(Nc3cc(ncn3)N3CCOCC3)c2[nH]1

BDBM50261267

Clc1cccc(Cl)c1-c1nc2ccnc(Nc3cc(ncn3)N3CCN(CC3)C3COC3)c2[nH]1

BDBM50261272

Cc1nccc(Nc2nccc3nc([nH]c23)-c2c(Cl)cccc2Cl)n1

BDBM50261215

F[C@@H]1C[C@@H]1C(=O)Nc1cc(NC(=O)c2c(F)cc(cc2Cl)C#N)ccn1 |r|

BDBM50261274

CNc1cc(Nc2nccc3nc([nH]c23)-c2c(Cl)cc(cc2Cl)C#N)ncn1

BDBM50261275

CN(C)c1nc(C)cc(Nc2nccc3nc([nH]c23)-c2c(Cl)cccc2Cl)n1

BDBM50261273

Cc1cc(Nc2nccc3nc([nH]c23)-c2c(Cl)cc(cc2Cl)C#N)ncn1

BDBM50261271

OCCN1CCN(CC1)c1cc(Nc2nccc3nc([nH]c23)-c2c(Cl)cccc2Cl)ncn1

BDBM50261284

CN(C)c1cc(Nc2nccc3nc([nH]c23)-c2c(Cl)cccc2Cl)nc(C)n1

BDBM50434821

c1cc(c(c(c1)Cl)C(=O)Nc2ccnc(c2)NC(=O)C3CC3)Cl

BDBM50261281

Clc1cccc(Cl)c1-c1nc2cc(NC(=O)C3CC3)ncc2[nH]1

BDBM50261282

Clc1cccc(Cl)c1-c1nc2ccnc(NC(=O)C3CC3)c2o1

BDBM50261283

Clc1cccc(Cl)c1-c1cc2ccnc(NC(=O)C3CC3)c2s1

BDBM50261774

C\C=C\C(=O)Nc1cccc(CNc2c(cnn3cccc23)C(N)=O)c1

BDBM50261776

NC(=O)c1cnn2cccc2c1NCc1cccc(NC(=O)CC#N)c1

BDBM50261777

CN(C)\C=C(\C#N)C(=O)Nc1cccc(CNc2c(cnn3cccc23)C(N)=O)c1

BDBM50261778

NC(=O)c1cnn2cccc2c1NCc1cccc(NC(=O)Cn2sc3ccccc3c2=O)c1

BDBM50261771

NC(=O)c1cnc(Nc2ccccc2)cc1NCc1ccccc1

BDBM50261772

NC(=O)c1cnn2cc(cc2c1NCc1ccccc1)-c1ccccc1

BDBM50261794

NC(=O)c1cnc(Nc2ccccc2)cc1NCc1cccc(NC(=O)C=C)c1

BDBM50261773

NC(=O)c1cnn2cccc2c1NCc1cccc(NC(=O)C=C)c1

BDBM50261775

NC(=O)c1cnn2cccc2c1NCc1cccc(NS(=O)(=O)C=C)c1

BDBM50261796

NC(=O)c1cnn2cccc2c1NCc1cccc(NC(=O)COc2c(F)c(F)c(F)c(F)c2F)c1

BDBM50224883

Clc1cc2NC(=O)Nc3cnc(C#N)c(OCCCCOc2cc1NCc1cncs1)n3

BDBM50374608

Cc1cccc(c1N2c3nc4ccccc4n3-c5c(cnc(n5)Nc6ccc(cc6)N7CCN(CC7)C)C2=O)C

BDBM50242740

CN1C(=O)N(Cc2cnc(N)nc12)c1cc(NC(=O)c2cccc(c2)C(F)(F)F)ccc1C

BDBM50264841

COc1cc(ccc1Nc1nc(NC2CCCCC2)c2cc[nH]c2n1)N1CCOCC1

BDBM50267826

C[C@@]1(CC[C@H](C1(C)C)Nc2c3cc(cn3ncc2C(=O)N)c4ccccc4)N

BDBM50267810

Cc1ccccc1-c1cc2c(N[C@@H]3CC[C@](C)(N)C3(C)C)c(cnn2c1)C(N)=O |r|

BDBM50267808

Cc1cccc(c1)-c1cc2c(N[C@@H]3CC[C@](C)(N)C3(C)C)c(cnn2c1)C(N)=O |r|

BDBM50267807

Cc1ccc(cc1)-c1cc2c(N[C@@H]3CC[C@](C)(N)C3(C)C)c(cnn2c1)C(N)=O |r|

BDBM50267806

COc1ccccc1-c1cc2c(N[C@@H]3CC[C@](C)(N)C3(C)C)c(cnn2c1)C(N)=O |r|

BDBM50267827

COc1cccc(c1)-c1cc2c(N[C@@H]3CC[C@](C)(N)C3(C)C)c(cnn2c1)C(N)=O |r|

BDBM50267828

COc1ccc(cc1)-c1cc2c(N[C@@H]3CC[C@](C)(N)C3(C)C)c(cnn2c1)C(N)=O |r|

BDBM50267829

C[C@]1(N)CC[C@@H](Nc2c(cnn3cc(cc23)-c2ccccc2F)C(N)=O)C1(C)C |r|

BDBM50267830

C[C@]1(N)CC[C@@H](Nc2c(cnn3cc(cc23)-c2cccc(F)c2)C(N)=O)C1(C)C |r|

BDBM50267835

C[C@]1(N)CC[C@@H](Nc2c(cnn3cc(cc23)-c2ccc(F)cc2)C(N)=O)C1(C)C |r|

BDBM50267836

C[C@]1(N)CC[C@@H](Nc2c(cnn3cc(cc23)-c2ccccc2Cl)C(N)=O)C1(C)C |r|

BDBM50267839

C[C@]1(N)CC[C@@H](Nc2c(cnn3cc(cc23)-c2cccc(Cl)c2)C(N)=O)C1(C)C |r|

BDBM50267840

C[C@]1(N)CC[C@@H](Nc2c(cnn3cc(cc23)-c2ccc(Cl)cc2)C(N)=O)C1(C)C |r|

BDBM50267846

C[C@]1(N)CC[C@@H](Nc2c(cnn3cc(cc23)-c2ccccc2C#N)C(N)=O)C1(C)C |r|

BDBM50267847

C[C@]1(N)CC[C@@H](Nc2c(cnn3cc(cc23)-c2cccc(c2)C#N)C(N)=O)C1(C)C |r|

BDBM50267848

C[C@]1(N)CC[C@@H](Nc2c(cnn3cc(cc23)-c2ccc(cc2)C#N)C(N)=O)C1(C)C |r|

BDBM141473

C[C@]1(N)CC[C@@H](Nc2c(cnn3cc(cc23)-c2cccnc2)C(N)=O)C1(C)C |r|

BDBM50267856

C[C@]1(N)CC[C@@H](Nc2c(cnn3cc(cc23)-c2ccncc2)C(N)=O)C1(C)C |r|

BDBM50267855

C[C@]1(N)CC[C@@H](Nc2c(cnn3cc(cc23)-c2cncnc2)C(N)=O)C1(C)C |r|

BDBM50267854

C[C@]1(N)CC[C@@H](Nc2c(cnn3cc(cc23)-c2cc[nH]n2)C(N)=O)C1(C)C |r|

BDBM50267853

Cc1cnccc1-c1cc2c(N[C@@H]3CC[C@](C)(N)C3(C)C)c(cnn2c1)C(N)=O |r|

BDBM50267852

Cc1cc(ccn1)-c1cc2c(N[C@@H]3CC[C@](C)(N)C3(C)C)c(cnn2c1)C(N)=O |r|

BDBM50267851

C[C@]1(N)CC[C@@H](Nc2c(cnn3cc(cc23)-c2ccncc2F)C(N)=O)C1(C)C |r|

BDBM50267850

C[C@]1(N)CC[C@@H](Nc2c(cnn3cc(cc23)-c2ccnc(F)c2)C(N)=O)C1(C)C |r|

BDBM50267849

COc1cc(ccn1)-c1cc2c(N[C@@H]3CC[C@](C)(N)C3(C)C)c(cnn2c1)C(N)=O |r|

BDBM141474

Cc1ccncc1-c1cc2c(N[C@@H]3CC[C@](C)(N)C3(C)C)c(cnn2c1)C(N)=O |r|

BDBM50267837

Cc1ccc(cn1)-c1cc2c(N[C@@H]3CC[C@](C)(N)C3(C)C)c(cnn2c1)C(N)=O |r|

BDBM50267838

C[C@]1(N)CC[C@@H](Nc2c(cnn3cc(cc23)-c2cncc(F)c2)C(N)=O)C1(C)C |r|

BDBM50267796

C[C@]1(N)CC[C@@H](Nc2c(cnn3cc(cc23)-c2ccc(F)nc2)C(N)=O)C1(C)C |r|

BDBM50267797

COc1ccc(cn1)-c1cc2c(N[C@@H]3CC[C@](C)(N)C3(C)C)c(cnn2c1)C(N)=O |r|

BDBM50267798

CCOc1ccc(cn1)-c1cc2c(N[C@@H]3CC[C@](C)(N)C3(C)C)c(cnn2c1)C(N)=O |r|

BDBM50267804

CC(C)Oc1ccc(cn1)-c1cc2c(N[C@@H]3CC[C@](C)(N)C3(C)C)c(cnn2c1)C(N)=O |r|

BDBM50267805

C[C@]1(N)CC[C@@H](Nc2c(cnn3cc(cc23)-c2ccc(nc2)C#N)C(N)=O)C1(C)C |r|

BDBM31340

COCC(=O)NC\C=C\c1ccc2ncnc(Nc3ccc(Oc4ccc(C)nc4)c(C)c3)c2c1

BDBM31090

CCOc1cc2c(cc1NC(=O)/C=C/CN(C)C)c(c(cn2)C#N)Nc3ccc(c(c3)Cl)F

BDBM7533

CC[C@H](CO)Nc1nc(NCc2ccccc2)c2ncn(C(C)C)c2n1 |r|

BDBM13531

Oc1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1

BDBM50110208

NC(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc2OCOc2c1)-c1ccccn1

BDBM50301356

CNc1ccn(-c2ccccc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cn1

BDBM50332296

Nc1nc(Nc2cccc(c2)S(N)(=O)=O)nn1C(=O)c1c(F)cccc1F

BDBM50332297

CCOC(=O)c1cccc(Nc2nc(N)n(n2)C(=O)c2c(F)cccc2F)c1

BDBM50332298

Nc1nc(Nc2cccc(c2)C(O)=O)nn1C(=O)c1c(F)cccc1F

BDBM50332299

COC(=O)c1ccc(Nc2nc(N)n(n2)C(=O)c2c(F)cccc2F)cc1

BDBM50332300

Nc1nc(Nc2ccc(cc2)C(O)=O)nn1C(=O)c1c(F)cccc1F

BDBM50332306

CCOC(=O)c1cccc(Nc2nc(N)nn2C(=O)c2c(F)cccc2F)c1

BDBM50332307

CCOC(=O)c1cccc(Nc2nnc(N)[nH]2)c1

BDBM50332301

Nc1nc(Nc2ccccc2)nn1C(=O)c1c(F)cccc1F

BDBM50332302

CN(C)c1cccc(Nc2nc(N)n(n2)C(=O)c2c(F)cccc2F)c1

BDBM50332303

CN(C)c1ccc(Nc2nc(N)n(n2)C(=O)c2c(F)cccc2F)cc1

BDBM50332304

Nc1nc(Nc2cccnc2)nn1C(=O)c1c(F)cccc1F

BDBM50332308

CCOC(=O)c1cccc(Nc2nc(N)n(n2)C(=O)c2ccccc2)c1

BDBM50332305

CCOC(=O)c1cccc(Nc2nc(N)n(n2)C(=O)c2ccccc2F)c1

BDBM50332309

CCOC(=O)c1cccc(Nc2nc(N)n(n2)C(=O)c2ccc(cc2)C(F)(F)F)c1

BDBM50332310

CCOC(=O)c1cccc(Nc2nc(N)n(n2)C(=O)c2ccc(cc2)N(C)C)c1

BDBM50332311

CCOC(=O)c1cccc(Nc2nc(N)n(n2)C(=O)c2ccco2)c1

BDBM50335232

Fc1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)C(F)(F)F |t:8|

BDBM50335233

FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCNCC1 |t:11|

BDBM50335234

CN(C)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)C(F)(F)F |t:10|

BDBM50335235

FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCN(CC1)C=O |t:11|

BDBM50335236

FC(F)(F)c1ccc(cc1C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)N1CCOCC1 |t:11|

BDBM50335237

c1ccc2c(c1)c(c[nH]2)C3=C(C(=O)NC3=O)c4c(cnc(n4)N5CCC(=O)CC5)C(F)(F)F

BDBM50384867

C1OCc2ccc(o2)-c2ccnc(Nc3cccc(COC\C=C\1)c3)n2 |t:23|

BDBM50384875

COCCOc1ccc2Nc3nccc(n3)-c3ccc(COC\C=C\CN(C)Cc1c2)o3 |t:24|

BDBM50384876

COCCOc1ccc2Nc3nccc(n3)-c3ccc(COC\C=C\CN(C)Cc1c2)s3 |t:24|

BDBM50384877

C(CN1CCCC1)Oc1ccc2Nc3nccc(n3)-c3ccc(COC\C=C\COCc1c2)s3 |t:28|

BDBM50384878

C(CN1CCCC1)Oc1ccc2Nc3nccc(n3)-c3csc(COC\C=C\COCc1c2)c3 |t:28|

BDBM50384879

C(CN1CCCC1)Oc1ccc2Nc3nccc(n3)-c3ccc(COC\C=C\COCc1c2)o3 |t:28|

BDBM50384880

C(CN1CCCC1)Oc1ccc2Nc3nccc(n3)-c3coc(COC\C=C\COCc1c2)c3 |t:28|

BDBM50384881

C(CN1CCCC1)Oc1ccc2Nc3nccc(n3)-c3cc(COC\C=C\COCc1c2)co3 |t:27|

BDBM50384883

CN1C\C=C\COCC2CCCN(C2)c2ccnc(Nc3cccc(C1)c3)n2 |t:3|

BDBM50384884

CN1C\C=C\CCn2ccc3ccc(cc23)-c2ccnc(Nc3cccc(C1)c3)n2 |t:3|

BDBM50384885

C1OCc2cccc(Nc3nccc(n3)-c3ccc4ccn(C\C=C\1)c4c3)c2 |t:24|

BDBM50384882

CN1C\C=C\CCOc2cc(ccn2)-c2ccnc(Nc3cccc(C1)c3)n2 |t:3|

BDBM50384864

CN1C\C=C\COCc2cncc(c2)-c2ccnc(Nc3cccc(C1)c3)n2 |t:3|

BDBM50384865

C1OCc2cccc(Nc3nccc(n3)-c3cncc(COC\C=C\1)c3)c2 |t:24|

BDBM50384866

CN1C\C=C\COCc2ccc(o2)-c2ccnc(Nc3cccc(C1)c3)n2 |t:3|

BDBM50384869

Cc1cnc2Nc3ccc(OCCN4CCCC4)c(COC\C=C\Cn4ccc5ccc(cc45)-c1n2)c3 |t:23|

BDBM50384870

C(CN1CCCC1)Oc1ccc2Nc3nccc(n3)-c3cncc(COC\C=C\COCc1c2)c3 |t:29|

BDBM50384871

C(CN1CCCC1)Oc1ccc2Nc3nccc(n3)-c3ccnc(OCC\C=C\COCc1c2)c3 |t:29|

BDBM50384872

Cc1cnc2Nc3ccc(OCCN4CCCC4)c(COC\C=C\CCOc4cc(ccn4)-c1n2)c3 |t:23|

BDBM50384873

CN1C\C=C\COCc2ccc(o2)-c2ccnc(Nc3ccc(OCCN4CCCC4)c(C1)c3)n2 |t:3|

BDBM50384874

CN1C\C=C\COCc2ccc(s2)-c2ccnc(Nc3ccc(OCCN4CCCC4)c(C1)c3)n2 |t:3|

BDBM50274586

CN(C)C(=O)C(=Cc1ccc(o1)c2nc3cnc4c(c3n2C5CCCCC5)cc[nH]4)C#N

BDBM50274605

N#C\C=C\c1ccc(o1)-c1nc2cnc3[nH]ccc3c2n1C1CCCCC1

BDBM50274604

CN(C)C(=O)CCc1ccc(o1)-c1nc2cnc3[nH]ccc3c2n1C1CCCCC1

BDBM50274601

c1cc(oc1CCC#N)c2nc3cnc4c(c3n2C5CCCCC5)cc[nH]4

BDBM50274584

N#CC(=Cc1ccc(o1)-c1nc2cnc3[nH]ccc3c2n1C1CCCCC1)C#N |(77.79,-13.81,;79.12,-14.58,;80.45,-15.35,;81.78,-14.58,;83.12,-15.36,;84.45,-14.58,;85.59,-15.61,;84.97,-17.01,;83.44,-16.86,;85.74,-18.34,;85.13,-19.74,;86.27,-20.77,;86.27,-22.32,;87.61,-23.09,;88.94,-22.31,;90.42,-22.78,;91.32,-21.52,;90.4,-20.28,;88.93,-20.76,;87.6,-20,;87.27,-18.5,;88.31,-17.36,;89.82,-17.68,;90.85,-16.53,;90.38,-15.06,;88.86,-14.74,;87.83,-15.89,;80.45,-16.88,;80.45,-18.42,)|

BDBM50274583

CN1CCN(CC1)C(=O)C(=Cc1ccc(o1)-c1nc2cnc3[nH]ccc3c2n1C1CCCCC1)C#N

BDBM50391993

C[C@@H]1CCN(C[C@@H]1n1cnc2cnc3[nH]ccc3c12)C(=O)CC#N |r|

BDBM50391994

C[C@@H]1CCN(Cc2ccccc2)C[C@@H]1N(C)c1ncnc2[nH]ccc12 |r|

BDBM50391995

C[C@@H]1CCN(Cc2ccccc2)C[C@@H]1n1cnc2cnc3[nH]ccc3c12 |r|

BDBM50391996

c1c[nH]c2c1c3c(cn2)ncn3[C@@H]4CCCN(C4)C(=O)CC#N

BDBM50391997

C(N1CCC[C@H](C1)n1cnc2cnc3[nH]ccc3c12)c1ccccc1 |r|

BDBM50391998

C(N1CCC[C@@H](C1)n1cnc2cnc3[nH]ccc3c12)c1ccccc1 |r|

BDBM50391999

C(N1CC[C@H](C1)n1cnc2cnc3[nH]ccc3c12)c1ccccc1 |r|

BDBM50392000

C(N1CC(C1)n1cnc2cnc3[nH]ccc3c12)c1ccccc1

BDBM50392001

c1ccc(cc1)CN2CCC(CC2)n3cnc4c3c5cc[nH]c5nc4

BDBM50393108

Nc1nc2c(nccc2[nH]1)-c1cnc2ccccc2c1

BDBM50393744

Cc1nc2cnc3[nH]ccc3c2n1[C@@H]1CCC[C@@H](O)C1 |r|

BDBM50399676

CN1CCN(CC1)c2ccc(cc2)Nc3ncc4c(n3)n(c(n4)Nc5ccccc5)C6CCCC6

BDBM50400289

CCS(=O)(=O)N1CCN(CC1)c1ccc2Nc3nccc(n3)-c3cccc(COCC=CCOCc1c2)c3 |w:30.31|

BDBM50400290

CC(=O)N1CCN(CC1)c1ccc2Nc3nccc(n3)-c3cccc(COCC=CCOCc1c2)c3 |w:28.29|

BDBM50400291

OCCN1CCN(CC1)c1ccc2Nc3nccc(n3)-c3cccc(COCC=CCOCc1c2)c3 |w:28.29|

BDBM50400292

CN1CCN(CC1)c1ccc2Nc3nccc(n3)-c3cccc(COCC=CCOCc1c2)c3 |w:26.27|

BDBM50400293

C1CN(CCN1)c1ccc2Nc3nccc(n3)-c3cccc(COCC=CCOCc1c2)c3 |w:25.26|

BDBM50400294

C1CN(CCO1)c1ccc2Nc3nccc(n3)-c3cccc(COCC=CCOCc1c2)c3 |w:25.26|

BDBM50400295

Oc1ccc2Nc3nccc(n3)-c3cccc(COCC=CCOCc1c2)c3 |w:20.20|

BDBM50400296

COc1ccc2Nc3nccc(n3)-c3cccc(COCC=CCOCc1c2)c3 |w:21.21|

BDBM50400297

COc1ccc2Nc3nccc(n3)-c3cccc(OCC=CCOCc1c2)c3 |w:20.20|

BDBM50400298

COc1ccc2Nc3nccc(n3)-c3cccc(OCCC=CCOCc1c2)c3 |w:21.21|

BDBM50400299

C1CC=CCOc2cccc(Nc3nccc(n3)-c3cccc(O1)c3)c2 |w:2.1|

BDBM50400300

C1CC=CCCOc2cccc(c2)-c2ccnc(Nc3cccc(O1)c3)n2 |w:3.3|

BDBM50400314

ClCCOc1ccc2Nc3nccc(n3)-c3cccc(COCC=CCOCc1c2)c3 |w:23.23|

BDBM50400317

CN(C)CCN(C)c1ccc2Nc3nccc(n3)-c3cccc(COCC=CCOCc1c2)c3 |w:26.26|

BDBM50400302

COc1ccc-2cc1COCC=CCOCc1cc(Nc3nccc-2n3)ccc1OCCN1CCCC1 |w:11.11|

BDBM50400315

Fc1cc2COCC=CCOCc3cc(Nc4nccc(n4)-c(c1)c2)ccc3OCCN1CCCC1 |w:7.6|

BDBM50400303

COc1ccc2COCC=CCOCc3cc(Nc4nccc(n4)-c1c2)ccc3OCCN1CCCC1 |w:9.8|

BDBM50400304

Fc1cnc2Nc3ccc(OCCN4CCCC4)c(COCC=CCOCc4cccc(c4)-c1n2)c3 |w:23.24|

BDBM50400305

Cc1cnc2Nc3ccc(OCCN4CCCC4)c(COCC=CCOCc4cccc(c4)-c1n2)c3 |w:23.24|

BDBM50400316

COc1cc2Nc3nccc(n3)-c3cccc(COCC=CCOCc(c2)c1OCCN1CCCC1)c3 |w:20.20|

BDBM50400306

CCN(CC)CCC(=O)Nc1cc2COCC=CCOCc3cccc(c3)-c3ccnc(Nc(c2)c1)n3 |w:17.17|

BDBM50400307

C(CN1CCOCC1)Oc1cc2COCC=CCOCc3cccc(c3)-c3ccnc(Nc(c2)c1)n3 |w:16.17|

BDBM50400308

C(CN1CCCC1)Oc1cc2COCC=CCOCc3cccc(c3)-c3ccnc(Nc(c2)c1)n3 |w:15.16|

BDBM50400309

O=C1CCN(CCOc2ccc3Nc4nccc(n4)-c4cccc(COCC=CCOCc2c3)c4)C1 |w:27.27|

BDBM50400310

O=C1CCCN1CCOc1ccc2Nc3nccc(n3)-c3cccc(COCC=CCOCc1c2)c3 |w:28.29|

BDBM50400311

C(CN1CCCCC1)Oc1ccc2Nc3nccc(n3)-c3cccc(COCC=CCOCc1c2)c3 |w:28.29|

BDBM50400312

C(CN1CCCC1)Oc1ccc2Nc3nccc(n3)-c3cccc(COCC=CCOCc1c2)c3 |w:27.28|

BDBM50400313

CCN(CC)CCOc1ccc2Nc3nccc(n3)-c3cccc(COCC=CCOCc1c2)c3 |w:27.27|

BDBM50401152

CC(C)(C)NS(=O)(=O)c1cncc(c1)-c1ccn2nc(N)nc2c1

BDBM50402020

CC(C)(C)Nc1c(Nc2ccnc(Nc3ccc(cc3)-c3ccncc3)n2)c(=O)c1=O

BDBM50402409

O=C(Nc1ccc(cc1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1)[C@H]1CCCN1 |r|

BDBM50288373

[H][C@]12CN(c3cnc(F)c(Nc4ncc(C)c(N[C@H](C)C(C)C)n4)c3)[C@]([H])(CN1C)C2 |r|

BDBM50413752

COc1cc(O)c2c(CCCC(=O)C(=O)C(O)CCC[C@H](C)OC2=O)c1 |r|

BDBM50288436

[H][C@]12CN(c3cnc(F)c(Nc4ncc(C)c(N[C@H](C)CC)n4)c3)[C@]([H])(CN1C)C2 |r|

BDBM50288510

[H][C@]12CN(c3cnc(F)c(Nc4ncc(C)c(NC(CC)CC)n4)c3)[C@]([H])(CN1C)C2 |r|

BDBM50426601

CC(C)(C)[C@@H](NC(=O)c1c[nH]c2ncc(nc12)C1CC1)C(=O)N1CC(C1)C#N |r|

BDBM50426733

C1CCC(CC1)c1ccc2cnc3[nH]ccc3n12

BDBM50426735

C1CCC(CC1)c1nnc2cnc3[nH]ccc3n12

BDBM50426740

C1CCC(CC1)N1CCCc2cnc3[nH]ccc3c12

BDBM50426737

C1CCC(CC1)c1noc2cnc3[nH]ccc3c12

BDBM50426738

Cn1nc(C2CCCCC2)c2c3cc[nH]c3ncc12

BDBM50426739

C1CCC(CC1)c1n[nH]c2cnc3[nH]ccc3c12

BDBM50361170

CS(=O)(=O)Nc1ccc(cc1)-c1ccnc(Nc2ccc(cc2)N2CCC(CC2)C(=O)NCCCCCCCC(=O)NO)n1

BDBM50361171

CS(=O)(=O)Nc1ccc(cc1)-c1ccnc(Nc2ccc(cc2)N2CCC(CC2)C(=O)Nc2ccc(\C=C\C(=O)NO)cc2)n1

BDBM50361177

ONC(=O)c1ccc(cc1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1

BDBM50460037

C(CN1CCCC1)Oc1ccc2Nc3nccc(n3)-c3ccc(OC\C=C\COCc1c2)o3 |t:27|

BDBM50460104

CN([C@@H]1CCN(C1)C(=O)CC#N)c1ncnc2[nH]ccc12 |r|

BDBM50463794

COCCn1cc(cn1)-c1nn(CC2CCCN(C2)C(=O)C=C)c2ncnc(N)c12

BDBM50463795

Cn1cc(cn1)-c1nn(C2CCCN(C2)C(=O)CC#N)c2ncnc(N)c12

BDBM50463788

Cn1cc(cn1)-c1nn(CC2CCCN(C2)C(=O)CC#N)c2ncnc(N)c12

BDBM50463799

Cn1cc(cn1)-c1nn(CC2CCCN(C2)C(=O)C=C)c2ncnc(N)c12

BDBM50463801

COCCn1cc(cn1)-c1nn(C2CCCN(C2)C(=O)C=C)c2ncnc(N)c12

BDBM50463817

COCCn1cc(cn1)-c1nn(CC2CCCN(C2)C(=O)CC#N)c2ncnc(N)c12

BDBM50463792

COCCn1cc(cn1)-c1nn(C2CCN(C2)C(=O)C=C)c2ncnc(N)c12

BDBM50463796

Cn1cc(cn1)-c1nn(C2CCCN(C2)C(=O)C=C)c2ncnc(N)c12

BDBM50463798

COCCn1cc(cn1)-c1nn(C2CCCN(C2)C(=O)CC#N)c2ncnc(N)c12

BDBM50463800

Cn1cc(cn1)-c1nn(C2CCN(C2)C(=O)C=C)c2ncnc(N)c12

BDBM50463838

NC(=O)c1cnc2[nH]ccc2c1NC1C2CC3CC1CC(O)(C3)C2 |TLB:13:14:22:17.18.19,12:13:22.16.17:19,THB:15:16:19:23.14.13,15:14:22.16.17:19,13:18:22:23.15.14,(62.43,-6.04,;61.1,-6.81,;61.1,-8.35,;59.76,-6.04,;59.75,-4.49,;58.42,-3.73,;57.08,-4.5,;55.61,-4.03,;54.71,-5.28,;55.62,-6.53,;57.09,-6.04,;58.42,-6.82,;58.42,-8.36,;57.14,-9.21,;57.12,-10.75,;56.11,-12.03,;54.69,-11.48,;54.69,-9.88,;55.72,-8.64,;54.38,-9.11,;54.39,-10.61,;53.04,-9.84,;53.19,-11.89,;55.71,-11.09,)|

BDBM50465999

CC[C@@H](C(=O)NCC(F)(F)F)n1c2c3cc[nH]c3ncc2c2cc(OC)c(OC)cc2c1=O |r|

BDBM50466000

COc1cc2c3cnc4[nH]ccc4c3n([C@@H]3CCCNC3)c(=O)c2cc1OC |r|

BDBM50466658

O[C@@H]1C[C@H](NC#N)c2cc(ccc12)-c1ncnc2[nH]ccc12 |r|

BDBM50466662

COCCc1c[nH]c2ncnc(-c3ccc4OC(F)(F)CN(C#N)c4c3)c12

BDBM50466657

COCCc1c[nH]c2ncnc(-c3ccc4OCCC(NC#N)c4c3)c12

BDBM50466668

COCCc1c[nH]c2ncnc(-c3ccc4OCCN(C(=O)C=C)c4c3)c12

BDBM50466669

CN(C#N)C1CCc2ccc(cc12)-c1ncnc2[nH]ccc12

BDBM50466672

N#CNC1CCc2ccc(cc12)-c1ncnc2[nH]ccc12

BDBM50466660

N#CN[C@H]1CCc2ccc(cc12)-c1ncnc2[nH]ccc12 |r|

BDBM50466673

N#CN[C@@H]1CCc2ccc(cc12)-c1ncnc2[nH]ccc12 |r|

BDBM50466659

N#CNC1CCOc2ccc(cc12)-c1ncnc2[nH]ccc12

BDBM50466674

N#CN[C@H]1CCOc2ccc(cc12)-c1ncnc2[nH]ccc12 |r|

BDBM50466675

C[C@@H]1Cc2ccc(cc2[C@@H]1NC#N)-c1ncnc2[nH]ccc12 |r|

BDBM50466683

CC1(CCc2ccc(cc12)-c1ncnc2[nH]ccc12)NC#N

BDBM50466676

C[C@@]1(CCc2ccc(cc12)-c1ncnc2[nH]ccc12)NC#N |r|

BDBM50466684

O[C@@H]1Cc2ccc(cc2[C@H]1NC#N)-c1ncnc2[nH]ccc12 |r|

BDBM50466665

CS(=O)(=O)N[C@@H]1C[C@H](NC#N)c2cc(ccc12)-c1ncnc2[nH]ccc12 |r|

BDBM50466671

Fc1cccc(c1)S(=O)(=O)N[C@@H]1C[C@H](NC#N)c2cc(ccc12)-c1ncnc2[nH]ccc12 |r|

BDBM50466680

COc1ccc(cc1)S(=O)(=O)N[C@@H]1C[C@H](NC#N)c2cc(ccc12)-c1ncnc2[nH]ccc12 |r|

BDBM50466663

N#CN[C@H]1CCc2ccc(cc12)-c1ncnc2[nH]cc(-c3ccccc3)c12 |r|

BDBM50466685

Cn1nccc1S(=O)(=O)N[C@@H]1C[C@H](NC#N)c2cc(ccc12)-c1ncnc2[nH]ccc12 |r|

BDBM50466679

COCCc1c[nH]c2ncnc(-c3cccc(NC(=O)C=C)c3)c12

BDBM50466681

N#CN[C@@H]1CCOc2ccc(cc12)-c1ncnc2[nH]ccc12 |r|

BDBM50466678

COCCS(=O)(=O)N[C@@H]1C[C@H](NC#N)c2cc(ccc12)-c1ncnc2[nH]ccc12 |r|

BDBM50466666

COCCc1c[nH]c2ncnc(-c3ccc4OCCN(C#N)c4c3)c12

BDBM50466670

COCCc1c[nH]c2ncnc(-c3ccc4CCC(NC#N)c4c3)c12

BDBM50466682

C[C@H]1Cc2ccc(cc2[C@@H]1NC#N)-c1ncnc2[nH]ccc12 |r|

BDBM50466661

O[C@H]1C[C@H](NC#N)c2cc(ccc12)-c1ncnc2[nH]ccc12 |r|

BDBM50466667

O=S(=O)(N[C@@H]1C[C@H](NC#N)c2cc(ccc12)-c1ncnc2[nH]ccc12)c1cccc(c1)C#N |r|

BDBM50466664

OCc1cccc(c1)-c1c[nH]c2ncnc(-c3ccc4CC[C@H](NC#N)c4c3)c12 |r|

BDBM50467407

ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1

BDBM50499634

OC(=O)C1CN(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)C1

BDBM106870

C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:6.8,3.3,1.0,(-.67,2.69,;-2,1.93,;-3.33,2.69,;-4.67,1.93,;-6,2.69,;-4.67,.38,;-3.33,-.38,;-2,.38,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;4.67,2.69,;6,1.93,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.93,)|

BDBM316605

C\C=C\C(=O)N1CCC[C@H](C1)Nc1ncnc2[nH]ccc12 |r|

BDBM50501535

[H][C@]12CCN(c3ncnc4[nH]ccc34)[C@@]1([H])CN(CC2)C(C)=O |r|

BDBM50501536

[H][C@]12CCN(c3ncnc4[nH]ccc34)[C@@]1([H])CN(CC2)C(=O)C=C |r|

BDBM50501537

C=CC(=O)Nc1cccc(c1)-c1ncnc2[nH]ccc12

BDBM316642

CN([C@@H]1CCCN(C1)C(=O)C=C)c1ncnc2[nH]ccc12 |r|

BDBM316524

C=CC(=O)N1CCC[C@H](C1)Nc1ncnc2[nH]ccc12 |r|

BDBM316639

C[C@@H]1CCN(C[C@@H]1N(C)c1ncnc2[nH]ccc12)C(=O)C=C |r|

BDBM50503288

NC(=O)c1cnc2[nH]ccc2c1N[C@H]1C2CC3CC1CC(C2)C3O |r,wU:13.14,TLB:21:20:17:15.14.13,12:13:17:19.22.20,THB:22:16:13:19.20.21,22:20:17.16.15:13,23:22:17:15.14.13,21:14:17:19.22.20,(37.51,-5.57,;38.85,-6.34,;38.85,-7.88,;40.18,-5.56,;40.18,-4.02,;41.53,-3.25,;42.86,-4.03,;44.33,-3.56,;45.23,-4.81,;44.31,-6.05,;42.85,-5.57,;41.52,-6.33,;41.51,-7.87,;42.77,-8.75,;44.12,-8.28,;43.08,-9.51,;43.09,-11.1,;41.58,-11.52,;42.78,-10.24,;44.11,-10.73,;45.51,-10.39,;45.52,-8.86,;44.49,-11.66,;44.89,-13.16,)|

BDBM50503287

CC[C@@H]1CN(C[C@@H]1c1cnc2cnc3[nH]ccc3n12)C(=O)NCC(F)(F)F |r|

BDBM50505541

[H][C@]12C[C@@H](NCCOCCOCCOCCNC(=O)CCC3=[N+]4C(C=C3)=Cc3c(C)cc(C)n3[B-]4(F)F)[C@@H](OC)[C@](C)(O1)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r,c:24,26,t:21|

BDBM50505542

[H][C@]12C[C@H]([C@@H](OC)[C@](C)(O1)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13)N(C)CCOCCOCCOCCNC(=O)CCC1=[N+]2C(C=C1)=Cc1c(C)cc(C)n1[B-]2(F)F |r,c:63,65,t:60|

BDBM50507816

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM50507817

NC(=O)c1nc(oc1Nc1ccc(cc1)C(=O)N1CCOCC1)-c1c(F)cccc1Cl

BDBM50509365

COc1cc2c(c[nH]c2cc1Br)-c1cnc(o1)-c1ccc[nH]1

BDBM50509865

COc1ccc(cn1)-c1cc2c(N[C@H](CO)[C@@H](C)O)c(cnn2c1)C(N)=O |r|

BDBM50509866

CC(C)CNc1c(cnn2cc(cc12)-c1ccccc1)C(N)=O

BDBM50509869

CC(C)CCNc1c(cnn2cc(cc12)-c1ccccc1)C(N)=O

BDBM50509870

CC(C)(C)CNc1c(cnn2cc(cc12)-c1ccccc1)C(N)=O

BDBM50509871

COc1ccc(cn1)-c1cc2c(NC(CO)[C@H](O)C3CC3)c(cnn2c1)C(N)=O |r|

BDBM50509875

COc1ccc(cn1)-c1cc2c(NC(CO)CO)c(cnn2c1)C(N)=O |@@:13|

BDBM50509876

C[C@H](O)[C@@H](CO)Nc1c(cnn2cc(cc12)-c1ccccc1)C(N)=O |r|

BDBM50509874

C[C@@H](O)[C@H](CO)Nc1c(cnn2cc(cc12)-c1ccccc1)C(N)=O |r|

BDBM50509877

COc1ccc(cn1)-c1cc2c(N[C@H](CO)CC(C)C)c(cnn2c1)C(N)=O |r|

BDBM50509867

COc1ccc(cn1)-c1cc2c(N[C@H](CO)CC3CC3)c(cnn2c1)C(N)=O |r|

BDBM50509868

CC(C)Nc1c(cnn2cc(cc12)-c1ccccc1)C(N)=O

BDBM50509878

NC(=O)c1cnn2cc(cc2c1NC1CCCC1)-c1ccccc1

BDBM50509872

C[C@@H](O)[C@@H](CO)Nc1c(cnn2cc(cc12)-c1ccccc1)C(N)=O |r|

BDBM50509873

C[C@H](O)[C@H](CO)Nc1c(cnn2cc(cc12)-c1ccccc1)C(N)=O |r|

BDBM50509949

COC[C@@H](C)Nc1cc(NC(=O)N2CCCc3cc(CN4CCCCOC4=O)c(C=O)nc23)ncc1C#N |r|

BDBM50510261

Cc1cnc(Nc2ccc(cc2)N2CCOCC2)nc1-c1cc2CN(CCc2o1)C(=O)CC#N

BDBM50510301

CC(Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1cc(F)ccc1Cl

BDBM50510303

COc1ccc(F)c(Cl)c1C(C)Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1

BDBM50510298

CC(Oc1cc(cnc1N)-c1cn[nH]c1)c1cc(F)ccc1Cl

BDBM50510307

COc1ccc(F)cc1C(C)Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1

BDBM50510302

CC(Oc1cc(cnc1N)-c1cccc(c1)N1CCNCC1)c1cc(F)ccc1Cl

BDBM50512068

ONC(=O)CCCCCn1cc(Nc2ncc(Cl)c(Nc3ccc(Cl)cc3)n2)cn1

BDBM50512074

ONC(=O)CCCCCCn1cc(Nc2ncc(Cl)c(Nc3ccc(Cl)cc3)n2)cn1

BDBM50512086

ONC(=O)CCCCCCn1cc(Nc2ncc(Cl)c(NC3CC3)n2)cn1

BDBM50512088

ONC(=O)CCCCCCn1cc(Nc2ncc(Cl)c(n2)N2CCCCC2)cn1

BDBM50512072

ONC(=O)CCCCCCn1cc(Nc2ncc(Cl)c(Nc3cccc(Cl)c3)n2)cn1

BDBM50519518

CNC(=O)c1cnc(Nc2cc(C)c(F)cn2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM50519521

CNC(=O)c1cnc(Nc2ccc(F)cn2)cc1Nc1cccc(C(N)=O)c1OC

BDBM50519522

CNC(=O)c1cnc(Nc2cc(C)c(F)cn2)cc1Nc1cccc(C(=O)NCCN2CCOCC2)c1OC

BDBM50519525

CNC(=O)c1cnc(Nc2ccc(F)cn2)cc1Nc1cccc(C(O)=O)c1OC

BDBM50519526

CNC(=O)c1cccc(Nc2cc(Nc3ccc(F)cn3)ncc2C(=O)NC)c1OC

BDBM50519527

CNC(=O)c1ccc(Nc2cc(Nc3ccc(F)cn3)ncc2C(=O)NC)c(OC)c1

BDBM50519528

CNC(=O)c1cnc(Nc2cc(C)c(F)cn2)cc1Nc1cccc(C(N)=O)c1OC

BDBM50519540

CNC(=O)c1cnc(Nc2cc(C)c(F)cn2)cc1Nc1cccc(C(=O)NC)c1OC

BDBM50519541

CNC(=O)c1cnc(Nc2cc(C)c(F)cn2)cc1Nc1cccc(C(=O)NCC2CC2)c1OC

BDBM50519531

Cc1cc(ncc1F)Nc2cc(c(cn2)C(=O)NC)Nc3cccc(c3OC)C(=O)NCc4ccccn4

BDBM50519532

CNC(=O)c1cnc(Nc2cc(C)c(F)cn2)cc1Nc1cccc(-c2nnc(C)o2)c1OC

BDBM50519519

CNC(=O)c1cnc(Nc2cc(C)c(F)cn2)cc1Nc1cccc(-c2ccn(C)n2)c1OC

BDBM50519533

CNC(=O)c1cnc(Nc2cc(C)c(F)cn2)cc1Nc1cccc(-c2ccnn2C)c1OC

BDBM50519534

CNC(=O)c1cnc(Nc2cc(C)c(F)cn2)cc1Nc1cccc(-c2nncn2C)c1OC

BDBM50519535

CNC(=O)c1cnc(Nc2cc(C)c(F)cn2)cc1Nc1cccc(-c2ncnn2C)c1OC

BDBM50519536

CNC(=O)c1cnc(Nc2ccc(cn2)C(F)(F)F)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM50519520

[2H]C([2H])([2H])NC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM50519544

CNC(=O)c1cccc(Nc2cc(Nc3ccc(F)cn3)ncc2C(=O)NC)c1

BDBM50519545

CNC(=O)c1cnc(Nc2cc(C)c(F)cn2)cc1Nc1cccc(C(=O)NCCO)c1OC

BDBM50519539

CNC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM50519546

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(c1)-c1ncn(C)n1

BDBM50519529

CCNC(=O)c1cccc(Nc2cc(Nc3cc(C)c(F)cn3)ncc2C(=O)NC)c1OC

BDBM50519524

CNC(=O)c1cnc(Nc2ccc(F)cn2)cc1Nc1cccc(C#N)c1OC

BDBM50519547

CNC(=O)c1cnc(Nc2ccc(F)cn2)cc1Nc1ccc(cc1OC)C(N)=O

BDBM50519530

CNC(=O)c1cnc(Nc2cc(C)c(F)cn2)cc1Nc1cccc(C(=O)N(C)C)c1OC

BDBM50519548

CNC(=O)c1cnc(Nc2cc(C)c(F)cn2)cc1Nc1cccc(-c2nnco2)c1OC

BDBM50519543

CNC(=O)c1cnc(Nc2cc(C)c(F)cn2)cc1Nc1cccc(-c2n[nH]c(C)n2)c1OC

BDBM50519538

CNC(=O)c1cnc(Nc2cc(C)nc(C)n2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM50519542

CNC(=O)c1cnc(Nc2cc(C)c(F)cn2)cc1Nc1cccc(-c2nc[nH]n2)c1OC

BDBM50519537

CNC(=O)c1cnc(Nc2ccc(cn2)C#N)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM50519662

CN(C)c1ccc(cc1)C(=O)Nc1cccc(NC(=O)COc2ccc3c(c2)occc3=O)c1

BDBM50526603

CNc1cc(Nc2cc(C)cc(C)c2)nn2c(cnc12)C(=O)NC1CC1

BDBM50526604

CNc1cc(Nc2cccn(-c3ccc(F)cn3)c2=O)nn2c(cnc12)C(=O)NC1CC1

BDBM50526605

CNc1cc(Nc2cccn(-c3ccccn3)c2=O)nn2c(cnc12)C(=O)NC1CCC1

BDBM50526606

CNc1cc(Nc2cccn(-c3ccccn3)c2=O)nn2c(cnc12)C(=O)N[C@@H]1C[C@@H]1F |r|

BDBM50526607

CNc1cc(Nc2cccn(-c3ccc(F)nc3)c2=O)nn2c(cnc12)C(=O)NC1CC1

BDBM50526608

CNc1cc(Nc2cccn(C3CC3)c2=O)nn2c(cnc12)C(=O)NC1CC1

BDBM50526609

CNc1cc(Nc2cccn(-c3cc(C)n(C)n3)c2=O)nn2c(cnc12)C(=O)NC1CC1

BDBM50526610

CNc1cc(nn2c1ncc2C(=O)NC3CC3)NC4=CC=CN(C4=O)c5ccc(cc5)C#N

BDBM50526611

CNc1cc(Nc2cccn(-c3ccncc3)c2=O)nn2c(cnc12)C(=O)NC1CC1

BDBM50526612

CNc1cc(Nc2cccn(-c3ccccn3)c2=O)nn2c(cnc12)C(=O)NCC(C)(C)CO

BDBM50526613

CNc1cc(Nc2cccn(-c3cccc(F)n3)c2=O)nn2c(cnc12)C(=O)N[C@@H]1C[C@@H]1F |r|

BDBM50526614

CNc1cc(Nc2cccn(C)c2=O)nn2c(cnc12)C(=O)NC1CC1

BDBM50526615

CNc1cc(Nc2cccn(-c3ccc(cc3)C(C)(C)O)c2=O)nn2c(cnc12)C(=O)NC1CC1

BDBM50526616

CNc1cc(Nc2cccn(-c3cccc(F)n3)c2=O)nn2c(cnc12)C(=O)NC1CC1

BDBM50526617

CNc1cc(Nc2cccn(-c3ncccc3F)c2=O)nn2c(cnc12)C(=O)NC1CC1

BDBM50526618

CNc1cc(Nc2cccn(-c3ncc(F)cn3)c2=O)nn2c(cnc12)C(=O)NC1CC1

BDBM50526619

CNc1cc(Nc2cccn(-c3ccc(F)cn3)c2=O)nn2c(cnc12)C(=O)N[C@@H]1C[C@@H]1F |r|

BDBM50526620

CNc1cc(Nc2cccn(-c3cc(C)n(C)n3)c2=O)nn2c(cnc12)C(=O)N[C@@H]1C[C@@H]1F |r|

BDBM50526621

CNc1cc(Nc2cccn(-c3ccccn3)c2=O)nn2c(cnc12)C(=O)NC(C)C

BDBM50526622

CNc1cc(Nc2cccn(-c3ccc(C)nn3)c2=O)nn2c(cnc12)C(=O)N[C@@H]1C[C@@H]1F |r|

BDBM50526623

CNc1cc(Nc2cccn(-c3ccccn3)c2=O)nn2c(cnc12)C(=O)NC1CC1

BDBM50526624

CNc1cc(Nc2cccn(-c3ccc(C)nn3)c2=O)nn2c(cnc12)C(=O)NC1CC1

BDBM264212

COc1nn(C)cc1Nc1nccc(n1)-c1c[nH]c2c(NC(=O)[C@@H](C)N3CCN(C)CC3)cccc12 |r|

BDBM50529610

CCNC(=O)c1ccc(cc1)Nc2nccc(n2)N3C[C@@H]4C[C@H]3CN4C(=O)CC#N

BDBM50529615

[H][C@]12CC[C@]([H])(CN(C1)c1nc(Nc3cnc(C(=O)NCC)c(C)c3)ncc1F)N2C(=O)C1CC1 |r|

BDBM50529616

[H][C@@]12CN(c3ccnc(Nc4ccc(cc4)C(=O)NCC)n3)[C@@]([H])(CN1C(=O)CC#N)C2 |r|

BDBM50529613

[H][C@]12CC[C@]([H])(CN(C1)c1nc(Nc3ccc(cn3)C(=O)NCC)ncc1F)N2C(=O)C1CC1 |r|

BDBM50529612

[H][C@]12CN(c3ccnc(Nc4ccc(cc4)C(=O)NCC)n3)[C@]([H])(CN1C(=O)C1CC1)C2 |r|

BDBM50529619

[H][C@]12CC[C@]([H])(CN(C1)c1ccnc(Nc3ccc(cc3)C(=O)NCC)n1)N2C(=O)C1CC1 |r|

BDBM50529609

[H][C@]12CC[C@]([H])(CN(C1)c1nc(Nc3cnn(C)c3)ncc1F)N2C(=O)C1CC1 |r|

BDBM50529617

CCNC(=O)c1ccc(Nc2nccc(n2)N2CCN(CC2)C(=O)CC#N)cc1

BDBM50529611

[H][C@]12CC[C@]([H])(CN(C1)c1nc(Nc3cnn(CCO)c3)ncc1F)N2C(=O)C1CC1 |r|

BDBM50529608

[H][C@]12C[C@]([H])(CN(C1)c1ccnc(Nc3ccc(cc3)C(=O)NCC)n1)N2C(=O)C1CC1 |r|

BDBM50529614

[H][C@@]12CC[C@@]([H])(CN1C(=O)C1CC1)N(C2)c1ccnc(Nc2ccc(cc2)C(=O)NCC)n1 |r|

BDBM50529618

[H][C@]12CC[C@]([H])(CN(C1)c1ccnc(Nc3cnn(C)c3)n1)N2C(=O)NCC(F)(F)F |r|

BDBM50530382

CNC(=O)c1cnc(Nc2ccccc2)cc1Nc1ccccc1C(N)=O

BDBM50530383

CS(=O)(=O)c1ccccc1Nc1cc(Nc2ccc(F)cn2)ncc1C(N)=O

BDBM50530381

CN(C)C(=O)c1cnc(Nc2ccc(F)cn2)cc1Nc1ccccc1C(N)=O

BDBM50530387

CNC(=O)c1cnc(NC(=O)C(C)C)cc1Nc1ccccc1S(C)(=O)=O

BDBM50519523

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2ccccn2)cc1Nc1ccccc1S(C)(=O)=O

BDBM50530379

CCS(=O)(=O)c1ccccc1Nc1cc(Nc2ccc(F)cn2)ncc1C(=O)NC

BDBM50530389

CNC(=O)c1cnc(cc1Nc2ccccc2S(=O)(=O)C)NC(=O)C3CC3

BDBM50530391

[2H]C([2H])([2H])NC(=O)c1cnc(Nc2ccc(F)cn2)cc1Nc1ccccc1S(C)(=O)=O

BDBM50530390

CNC(=O)c1cnc(Nc2ncccn2)cc1Nc1ccccc1C(N)=O

BDBM50530394

NC(=O)c1ccccc1Nc1cc(Nc2ccc(F)cn2)ncc1C(N)=O

BDBM50530396

CNC(=O)c1cnc(Nc2ccccn2)cc1Nc1ccccc1S(C)(=O)=O

BDBM50530395

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1ccccc1S(C)(=O)=O

BDBM50530397

CCNC(=O)c1cnc(Nc2ccc(F)cn2)cc1Nc1ccccc1C(N)=O

BDBM50530378

NC(=O)c1ccccc1Nc1cc(Nc2ccc(F)cn2)ncc1C(=O)NC1CC1

BDBM50530386

CNC(=O)c1cnc(cc1Nc2ccccc2C(=O)N)Nc3ccc(cn3)F

BDBM50530402

CNC(=O)c1cnc(Nc2ccc(F)cn2)cc1Nc1ccccc1OC

BDBM50530398

CNC(=O)c1cnc(cc1Nc2ccccc2S(=O)(=O)C)Nc3ccc(cn3)F

BDBM50530392

CNC(=O)c1cnc(Nc2ccc(F)cn2)cc1Nc1ccccc1SC

BDBM50530385

CNC(=O)c1cnc(Nc2ccc(cn2)N2CCOCC2)cc1Nc1ccccc1S(C)(=O)=O

BDBM50530388

CNC(=O)c1cnc(Nc2ccc(C)nn2)cc1Nc1ccccc1S(C)(=O)=O

BDBM50530403

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2ccc(F)cn2)cc1Nc1ccccc1S(C)(=O)=O

BDBM50530404

CNc1cc(Nc2cc(F)cc(F)c2OC)nn2c(cnc12)C(=O)NC[C@](C)(O)CO |r|

BDBM50530384

CNC(=O)c1cnc(Nc2ccc(F)cn2)cc1Nc1ccccc1

BDBM50530399

CNC(=O)c1cnc(Nc2ccc(F)cn2)cc1Nc1ccc(F)c(F)c1OC

BDBM50530393

CNC(=O)c1cnc(Nc2ccccn2)cc1Nc1ccccc1C(N)=O

BDBM50530380

CCCC(=O)Nc1cc(Nc2ccccc2S(C)(=O)=O)c(cn1)C(=O)NC

BDBM50530405

CNC(=O)c1cnc(Nc2ncccc2F)cc1Nc1ccccc1C(N)=O

BDBM50530400

CNC(=O)c1cnc(Nc2cc(C)ccn2)cc1Nc1ccccc1S(C)(=O)=O

BDBM50530401

CNC(=O)c1cnc(Nc2ccc(OC)cn2)cc1Nc1ccccc1S(C)(=O)=O

BDBM50530793

O=c1[nH]c2cnc(Nc3ccc[nH]c3=O)nc2n1[C@H]1CC[C@H](CC#N)CC1 |r,wU:18.20,wD:21.24,(13.29,-42.56,;11.75,-42.56,;10.84,-43.81,;9.37,-43.33,;8.04,-44.11,;6.7,-43.34,;6.71,-41.8,;5.37,-41.02,;5.37,-39.48,;6.71,-38.72,;6.71,-37.18,;5.38,-36.41,;4.04,-37.19,;4.05,-38.73,;2.72,-39.5,;8.04,-41.02,;9.37,-41.79,;10.84,-41.32,;11.31,-39.85,;10.28,-38.72,;10.76,-37.25,;12.27,-36.93,;12.74,-35.48,;14.24,-35.16,;15.74,-34.84,;13.29,-38.08,;12.82,-39.54,)|

BDBM50536196

CCc1cc(O)c(F)cc1-c1cc(NP(=O)(CC)CC)c2cn[nH]c2c1

BDBM50536198

CCc1cc(O)c(F)cc1-c1cc(NS(=O)(=O)N(C)C)c2cn[nH]c2c1

BDBM50536214

CCc1cc(O)c(F)cc1-c1cc(NS(=O)(=O)c2ccccc2Cl)c2cn[nH]c2c1

BDBM50536203

CCc1cc(O)c(F)cc1-c1cc(NS(=O)(=O)CCN2CCN(C)CC2)c2cn[nH]c2c1

BDBM50536200

CCc1cc(O)c(F)cc1-c1cc(NS(=O)(=O)CCC(=O)OC)c2cn[nH]c2c1

BDBM50536215

CCc1cc(O)c(F)cc1-c1cc(NS(=O)(=O)CCOC)c2cn[nH]c2c1

BDBM50536197

CCc1cc(O)c(F)cc1-c1cc(NS(=O)(=O)C2CCCC2)c2cn[nH]c2c1

BDBM50536216

CCc1cc(O)c(F)cc1-c1cc(NS(=O)(=O)CC2CCC2)c2cn[nH]c2c1

BDBM50536199

CCS(=O)(=O)Nc1cc(cc2[nH]ncc12)-c1c(C)cc(O)cc1C

BDBM50536210

CCS(=O)(=O)Nc1cc(cc2[nH]ncc12)-c1ccc(O)c(Cl)c1

BDBM50536202

CCS(=O)(=O)Nc1cc(cc2[nH]ncc12)-c1ccc(O)c(C)c1

BDBM50536212

CCc1cc(O)ccc1-c1cc(NS(=O)(=O)CC)c2cn[nH]c2c1

BDBM50536204

CCc1cc(O)c(F)cc1-c1cc(NS(=O)(=O)c2cccnc2)c2cn[nH]c2c1

BDBM50536201

CCc1cc(O)c(F)cc1-c1cc(NS(=O)(=O)CCN2CCCCC2)c2cn[nH]c2c1

BDBM50536206

CCc1cc(O)c(F)cc1-c1cc(NS(=O)(=O)C(F)(F)F)c2cn[nH]c2c1

BDBM50536223

CCS(=O)(=O)Nc1cc(cc2[nH]ncc12)-c1ccc(O)cc1C

BDBM50536218

CCS(=O)(=O)Nc1cc(cc2[nH]ncc12)-c1ccc(O)c(F)c1

BDBM50536221

CCc1cc(O)c(F)cc1-c1cc(NS(=O)(=O)C2CC2)c2cn[nH]c2c1

BDBM50536211

CCS(=O)(=O)Nc1cc(cc2[nH]ncc12)-c1ccc(O)cc1Cl

BDBM50536208

CCc1cc(O)c(F)cc1-c1cc(NS(=O)(=O)CC)c2cn[nH]c2c1

BDBM50536220

CCc1cc(O)c(F)cc1-c1cc(NS(=O)(=O)c2ccccn2)c2cn[nH]c2c1

BDBM50536205

CCc1cc(O)c(F)cc1-c1cc(NS(=O)(=O)CCO)c2cn[nH]c2c1

BDBM50536195

CCS(=O)(=O)Nc1cc(cc2[nH]ncc12)-c1ccc(O)c(OC)c1

BDBM50536222

CCS(=O)(=O)Nc1cc(cc2[nH]ncc12)-c1ccc(O)cc1

BDBM50536679

Cn1cc(cn1)-c1cnc2c(cnn2c1)-c1csc(c1)C(=O)N[C@@H]1CCCC[C@@H]1N |r|

BDBM50536681

Cc1sc(cc1-c1cnn2cc(Cl)cnc12)C(=O)N[C@@H]1[C@H](N)CCCC1(F)F |r|

BDBM50536678

Cn1cc(cn1)-c1cnc2c(cnn2c1)-c1csc(c1)C(=O)NCC(F)(F)F

BDBM50536675

FC(F)(F)CNC(=O)c1cc(cs1)-c1cnn2cc(cnc12)-c1ccc(OCCN2CCCCC2)cc1

BDBM50537421

C=CC(=O)Nc1ccc(CNc2cc(Nc3ccc(cc3)N3CCOCC3)ncn2)cc1

BDBM50537415

OCCn1cc(Nc2cc(NCc3cccc(NC(=O)C=C)c3)ncn2)cn1

BDBM50537436

OCCn1cc(Nc2cc(NCc3ccc(NC(=O)C=C)cc3)ncn2)cn1

BDBM50537441

COCCn1cc(Nc2cc(NCc3cccc(NC(=O)C=C)c3)ncn2)cn1

BDBM50537427

C=CC(=O)Nc1cccc(CNc2cc(Nc3ccc(cc3)N3CCOCC3)ncn2)c1

BDBM50109518

CN1CCN(CC1)c1ccc(Nc2cc(NCc3cccc(NC(=O)C=C)c3)ncn2)cc1

BDBM50537442

CN1CCN(CC1)c1ccc(Nc2cc(NCc3ccc(NC(=O)C=C)cc3)ncn2)cc1

BDBM50537433

COCCn1cc(Nc2cc(NCc3cccc(NC(=O)CC#N)c3)ncn2)cn1

BDBM50537417

O=C(CC#N)Nc1ccc(CNc2cc(Nc3ccc(cc3)N3CCOCC3)ncn2)cc1

BDBM50537426

COCCn1cc(Nc2cc(NCc3ccc(NC(=O)C=C)cc3)ncn2)cn1

BDBM50537444

CN1CCN(CC1)c1ccc(Nc2cc(NCc3cccc(NC(=O)CC#N)c3)ncn2)cc1

BDBM50537742

C[C@@H]1C[C@H]1C(=O)N1CCN(C[C@H]1C)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|

BDBM50539122

COc1cnc(Nc2ccc3B(O)OCc3c2)nc1Oc1cccc(NC(=O)C=C)c1

BDBM50539124

OB(O)c1ccc(Nc2ncc(c(Nc3cccc(NC(=O)C=C)c3)n2)C(F)(F)F)cc1

BDBM50539125

CC1(C)OB(O)c2cc(Nc3ncc(c(Nc4cccc(NC(=O)C=C)c4)n3)C(F)(F)F)ccc12

BDBM50539127

OB1OCCc2ccc(Nc3ncc(c(Nc4cccc(NC(=O)C=C)c4)n3)C(F)(F)F)cc12

BDBM50539128

OB1OCc2cc(Nc3ncc(c(Nc4cccc(NC(=O)C=C)c4)n3)C(F)(F)F)ccc12

BDBM50539129

OB1OCc2ccc(Nc3ncc(c(Nc4cccc(NC(=O)C=C)c4)n3)C(F)(F)F)cc12

BDBM50539811

Cc1c2c(n[nH]1)NC(=O)C=C2c3ccccc3

BDBM50539812

Cc1[nH]nc2[nH]c(=O)cc(C3CCCCC3)c12

BDBM50539813

Cc1[nH]nc2[nH]c(=O)cc(C3CCCC3)c12

BDBM50539814

Cc1[nH]nc2[nH]c(=O)cc(CC3CCC3)c12

BDBM50539815

C[C@@H]1CCCC[C@@H]1c1cc(=O)[nH]c2n[nH]c(C)c12 |r|

BDBM50539816

[H][C@]12CC[C@]([H])(C1)[C@@H](C2)c1cc(=O)[nH]c2n[nH]c(C)c12 |r|

BDBM50539817

[H][C@]12CC[C@]([H])(C1)[C@H](C2)c1cc(=O)[nH]c2n[nH]c(C)c12 |r|

BDBM50539818

Cc1[nH]nc2[nH]c(=O)cc(C3CC4CCC3CC4)c12 |(14.47,-21.16,;14.94,-22.62,;14.03,-23.86,;14.94,-25.12,;16.41,-24.64,;17.75,-25.4,;19.08,-24.64,;20.42,-25.41,;19.08,-23.09,;17.75,-22.31,;17.75,-20.77,;16.42,-20.01,;16.43,-18.46,;17.77,-17.7,;19.09,-18.48,;19.09,-20.01,;17.55,-20,;17.97,-18.46,;16.41,-23.09,)|

BDBM50539819

O=c1cc(C2CCCCC2)c2c[nH]nc2[nH]1

BDBM50539821

O=c1cc(C2CCCCC2)c2c([nH]nc2[nH]1)C1CC1

BDBM50539822

Cc1[nH]nc2[nH]c(=O)c(CO)c(C3CCCCC3)c12

BDBM50539823

Cc1[nH]nc2[nH]c(=O)c(CCO)c(C3CCCCC3)c12

BDBM50539824

Cc1[nH]nc2[nH]c(=O)c(C#N)c(C3CCCCC3)c12

BDBM50539825

Cc1[nH]nc2[nH]c(=O)cc([C@H]3CC[C@H](CC#N)CC3)c12 |r,wU:10.9,wD:13.13,(4.89,-10.9,;5.37,-12.37,;4.45,-13.61,;5.37,-14.86,;6.84,-14.39,;8.17,-15.15,;9.5,-14.39,;10.84,-15.16,;9.5,-12.84,;8.17,-12.06,;8.18,-10.52,;6.85,-9.75,;6.86,-8.21,;8.2,-7.44,;8.2,-5.9,;9.54,-5.14,;10.88,-4.38,;9.52,-8.22,;9.52,-9.75,;6.84,-12.84,)|

BDBM50539828

Cc1[nH]nc2[nH]c(=O)cc([C@H]3CC[C@@H](CC3)NC(=O)C3CC3)c12 |r,wU:10.9,wD:13.16,(41.39,-11.13,;41.86,-12.59,;40.95,-13.84,;41.86,-15.09,;43.33,-14.61,;44.67,-15.37,;46,-14.61,;47.34,-15.38,;46,-13.07,;44.67,-12.28,;44.68,-10.74,;43.35,-9.97,;43.36,-8.43,;44.69,-7.67,;46.02,-8.44,;46.02,-9.98,;44.7,-6.13,;43.37,-5.35,;42.04,-6.11,;43.38,-3.81,;44.16,-2.49,;42.62,-2.48,;43.33,-13.07,)|

BDBM50539829

Cc1[nH]nc2[nH]c(=O)cc([C@H]3CC[C@@H](CC3)C(=O)NC3CC3)c12 |r,wU:10.9,wD:13.16,(52.09,-9.68,;52.57,-11.15,;51.65,-12.39,;52.57,-13.64,;54.04,-13.17,;55.37,-13.93,;56.7,-13.17,;58.04,-13.94,;56.7,-11.62,;55.37,-10.84,;55.38,-9.3,;54.05,-8.53,;54.06,-6.99,;55.4,-6.22,;56.72,-7,;56.72,-8.53,;55.4,-4.68,;56.74,-3.92,;54.08,-3.91,;52.74,-4.67,;51.2,-4.66,;51.97,-6,;54.04,-11.62,)|

BDBM50539830

Cc1[nH]nc2[nH]c(=O)cc([C@H]3CC[C@@H](CC3)NC(=O)C3CCCC3)c12 |r,wU:10.9,wD:13.16,(60.58,-12.25,;61.06,-13.71,;60.14,-14.96,;61.06,-16.21,;62.53,-15.73,;63.86,-16.49,;65.19,-15.73,;66.53,-16.5,;65.19,-14.19,;63.86,-13.4,;63.87,-11.86,;62.54,-11.09,;62.55,-9.55,;63.89,-8.79,;65.21,-9.56,;65.21,-11.1,;63.89,-7.25,;62.57,-6.47,;61.23,-7.23,;62.57,-4.93,;63.82,-4.03,;63.35,-2.56,;61.81,-2.56,;61.33,-4.02,;62.53,-14.19,)|

BDBM50539831

Cc1c2c(n[nH]1)NC(=O)C=C2C3CCC(CC3)NC(=O)[C@@H]4CC4(F)F

BDBM50539832

Cc1[nH]nc2[nH]c(=O)cc([C@H]3CC[C@@H](CC3)NC(=O)[C@H]3CC3(F)F)c12 |r,wU:10.9,wD:13.16,19.19,(17.05,-29.9,;17.52,-31.36,;16.61,-32.61,;17.52,-33.86,;18.99,-33.38,;20.33,-34.14,;21.65,-33.38,;22.99,-34.15,;21.65,-31.84,;20.33,-31.05,;20.34,-29.51,;19.01,-28.75,;19.02,-27.21,;20.35,-26.44,;21.68,-27.22,;21.67,-28.75,;20.36,-24.9,;19.03,-24.13,;17.7,-24.89,;19.04,-22.59,;19.81,-21.26,;18.26,-21.25,;16.73,-21.25,;17.49,-19.92,;18.99,-31.84,)|

BDBM50539836

Cc1[nH]nc2[nH]c(=O)cc([C@H]3CC[C@H](N)CC3)c12 |r,wU:10.9,wD:13.13,(57.4,-28.32,;57.87,-29.79,;56.96,-31.03,;57.87,-32.28,;59.34,-31.81,;60.68,-32.57,;62,-31.81,;63.34,-32.58,;62,-30.26,;60.68,-29.48,;60.69,-27.94,;59.36,-27.17,;59.37,-25.63,;60.7,-24.87,;60.71,-23.33,;62.03,-25.64,;62.02,-27.17,;59.34,-30.26,)|

BDBM50539837

Cc1[nH]nc2[nH]c(=O)cc([C@H]3CC[C@H](O)CC3)c12 |r,wU:10.9,wD:13.13,(66.08,-28.71,;66.55,-30.17,;65.64,-31.42,;66.55,-32.67,;68.02,-32.19,;69.35,-32.95,;70.68,-32.19,;72.02,-32.96,;70.68,-30.65,;69.35,-29.87,;69.36,-28.33,;68.04,-27.56,;68.04,-26.02,;69.38,-25.25,;69.39,-23.72,;70.71,-26.03,;70.7,-27.56,;68.02,-30.65,)|

BDBM50539843

[H][C@]12C[C@@H](c3cc(=O)[nH]c4n[nH]c(C)c34)[C@]([H])(C[C@H]1CC#N)C2 |r|

BDBM50539844

[H][C@@]12C[C@H](c3cc(=O)[nH]c4n[nH]c(C)c34)[C@@]([H])(C[C@@H]1CC#N)C2 |r|

BDBM50539845

[H][C@]12C[C@@H](c3cc(=O)[nH]c4n[nH]c(C)c34)[C@]([H])(C[C@@H]1CC#N)C2 |r|

BDBM50539846

[H][C@@]12C[C@H](c3cc(=O)[nH]c4n[nH]c(C)c34)[C@@]([H])(C[C@H]1CC#N)C2 |r|

BDBM50542396

CCNC(=O)c1ccc(Nc2nccc(n2)N2CC3CCC(C2)N3C(=O)C2CC2)cc1

BDBM50542397

OCCn1cc(Nc2ncc(F)c(n2)N2CC3CCC(C2)N3C(=O)C2CC2)cn1

BDBM50542398

CCNC(=O)c1ccc(Nc2nccc(n2)N2CC3CC(C2)N3C(=O)C2CC2)cc1

BDBM50542399

c1c(cn(n1)CCO)Nc2ncc(c(n2)N3C[C@H]4C[C@]4(C3)NC(=O)C5CC5)F

BDBM50542400

[H][C@@]12C[C@@]1(CN(C2)c1nc(Nc2cnn(CCO)c2)ncc1F)NC(=O)C1CC1 |r|

BDBM50542401

[H][C@@]12CN(C[C@]1(NC(=O)C1CC1)[C@@H]2C)c1nc(Nc2cnn(CCO)c2)ncc1F |r|

BDBM50542402

c1c(cn(n1)CCO)Nc2ncc(c(n2)N3C[C@H]4C[C@]4(C3)NC(=O)[C@@H]5C[C@H]5C#N)F

BDBM50542403

c1c(cn(n1)CCO)Nc2ncc(c(n2)N3C[C@H]4C[C@]4(C3)NC(=O)[C@H]5C[C@@H]5C#N)F

BDBM50542404

[H][C@@]12CN(C[C@]1(NC(=O)[C@@H]1C[C@H]1C#N)[C@@H]2C)c1nc(Nc2cnn(CCO)c2)ncc1F |r|

BDBM50542405

[H][C@@]12CN(C[C@]1(NC(=O)[C@H]1C[C@@H]1C#N)[C@@H]2C)c1nc(Nc2cnn(CCO)c2)ncc1F |r|

BDBM50542406

[H][C@@]12CN(C[C@]1(NC(=O)[C@H]1C[C@@H]1C#N)[C@@H]2C)c1nc(Nc2cnn(C)c2)ncc1F |r|

BDBM50544782

[H][C@@]12CN(C(=O)[C@]1(C#N)C1CC1)c1ccnc(Nc3cccc(COC\C=C/COC2)n3)c1 |r,c:28|

BDBM50544783

[H][C@@]12CN(C(=O)[C@]1(C#N)C1CC1)c1ccnc(Nc3cccc(COC\C=C\COC2)n3)c1 |r,t:28|

BDBM50544784

[H][C@@]12CN(C(=O)[C@]1(C#N)C1CC1)c1ccnc(Nc3cccc(CCCNC(=O)COC2)n3)c1 |r|

BDBM50544785

[H][C@@]12CN(C(=O)[C@]1(C#N)C1CC1)c1ccnc(Nc3cccc(CCNC(=O)COC2)n3)c1 |r|

BDBM50544786

[H][C@@]12CN(C(=O)[C@]1(C#N)C1CC1)c1ccnc(Nc3cccc(CNC(=O)COC2)n3)c1 |r|

BDBM50544787

[H][C@@]12CN(C(=O)[C@]1(C#N)C1CC1)c1ccnc(Nc3cccc(COCCCCOC2)n3)c1 |r|

BDBM50544788

CN(C)C(=O)c1ccc(nc1)Nc2cc(ccn2)N3CC[C@@](C3=O)(C#N)C4CC4

BDBM50545650

C[C@H]1CN([C@]12CCN(C2)c3c4cc[nH]c4ncn3)C(=O)CC#N

BDBM50548370

Cn1ccc(n1)-c1cn2nccc2c(n1)-c1cnn(c1)[C@@]1(CC#N)C[C@@H](C1)C#N |r,wU:20.23,wD:25.31,(31.83,-17.42,;30.3,-17.58,;29.53,-18.92,;28.02,-18.6,;27.86,-17.07,;29.27,-16.44,;26.53,-16.3,;25.2,-17.07,;23.86,-16.3,;22.4,-16.77,;21.49,-15.53,;22.4,-14.28,;23.86,-14.76,;25.2,-13.99,;26.53,-14.76,;25.2,-12.45,;26.44,-11.54,;25.97,-10.07,;24.43,-10.07,;23.95,-11.54,;23.53,-8.83,;22.75,-10.16,;21.21,-10.14,;19.67,-10.13,;22.01,-8.59,;22.25,-7.07,;23.77,-7.31,;21.35,-5.82,;20.44,-4.58,)|

BDBM50548371

Cn1ccc(n1)-c1cn2nccc2c(n1)-c1cnn(c1)[C@]1(CC#N)C[C@@H](C1)C#N |r,wU:20.23,25.31,(18.97,-17.08,;17.44,-17.24,;16.67,-18.58,;15.17,-18.25,;15.01,-16.73,;16.42,-16.1,;13.67,-15.96,;12.34,-16.73,;11.01,-15.96,;9.54,-16.43,;8.64,-15.19,;9.54,-13.94,;11.01,-14.42,;12.34,-13.65,;13.67,-14.42,;12.34,-12.11,;13.59,-11.19,;13.11,-9.73,;11.57,-9.73,;11.09,-11.19,;10.68,-8.49,;9.89,-9.82,;8.35,-9.8,;6.81,-9.79,;10.92,-6.97,;9.4,-6.73,;9.15,-8.25,;8.49,-5.48,;7.59,-4.24,)|

BDBM50548372

N#CC[C@@]1(C[C@@H](C1)C#N)n1cc(cn1)-c1nc(cn2nccc12)-c1cc[nH]n1 |r,wU:3.9,wD:5.7,(19.67,-10.13,;21.21,-10.14,;22.75,-10.16,;23.53,-8.83,;22.01,-8.59,;22.25,-7.07,;23.77,-7.31,;21.35,-5.82,;20.44,-4.58,;24.43,-10.07,;23.95,-11.54,;25.2,-12.45,;26.44,-11.54,;25.97,-10.07,;25.2,-13.99,;26.53,-14.76,;26.53,-16.3,;25.2,-17.07,;23.86,-16.3,;22.4,-16.77,;21.49,-15.53,;22.4,-14.28,;23.86,-14.76,;27.86,-17.07,;28.02,-18.6,;29.53,-18.92,;30.3,-17.58,;29.27,-16.44,)|

BDBM50548373

N#CC[C@]1(C[C@@H](C1)C#N)n1cc(cn1)-c1nc(cn2nccc12)-c1cc[nH]n1 |r,wU:3.9,5.7,(6.81,-9.79,;8.35,-9.8,;9.89,-9.82,;10.68,-8.49,;10.92,-6.97,;9.4,-6.73,;9.15,-8.25,;8.49,-5.48,;7.59,-4.24,;11.57,-9.73,;11.09,-11.19,;12.34,-12.11,;13.59,-11.19,;13.11,-9.73,;12.34,-13.65,;13.67,-14.42,;13.67,-15.96,;12.34,-16.73,;11.01,-15.96,;9.54,-16.43,;8.64,-15.19,;9.54,-13.94,;11.01,-14.42,;15.01,-16.73,;15.17,-18.25,;16.67,-18.58,;17.44,-17.24,;16.42,-16.1,)|

BDBM50548374

N#CC[C@@]1(C[C@@H](C1)C#N)n1cc(cn1)-c1nc(cn2nccc12)-c1cn[nH]c1 |r,wU:3.9,wD:5.7,(20.45,-9.68,;21.99,-9.68,;23.53,-9.7,;24.31,-8.37,;22.79,-8.13,;23.03,-6.61,;24.55,-6.85,;22.13,-5.37,;21.22,-4.12,;25.21,-9.61,;24.73,-11.08,;25.98,-11.99,;27.22,-11.08,;26.75,-9.61,;25.98,-13.53,;27.31,-14.3,;27.31,-15.84,;25.98,-16.61,;24.64,-15.84,;23.18,-16.31,;22.27,-15.07,;23.18,-13.82,;24.64,-14.3,;28.64,-16.61,;28.8,-18.14,;30.3,-18.46,;31.07,-17.12,;30.05,-15.98,)|

BDBM50548375

N#CC[C@]1(C[C@@H](C1)C#N)n1cc(cn1)-c1nc(cn2nccc12)-c1cn[nH]c1 |r,wU:3.9,5.7,(6.81,-9.79,;8.35,-9.8,;9.89,-9.82,;10.68,-8.49,;10.92,-6.97,;9.4,-6.73,;9.15,-8.25,;8.49,-5.48,;7.59,-4.24,;11.57,-9.73,;11.09,-11.19,;12.34,-12.11,;13.59,-11.19,;13.11,-9.73,;12.34,-13.65,;13.67,-14.42,;13.67,-15.96,;12.34,-16.73,;11.01,-15.96,;9.54,-16.43,;8.64,-15.19,;9.54,-13.94,;11.01,-14.42,;15.01,-16.73,;15.17,-18.25,;16.67,-18.58,;17.44,-17.24,;16.42,-16.1,)|

BDBM50548378

Cn1cc(cn1)-c1cc(-c2cnn(c2)C2(CC#N)CN(CC(F)(F)F)C2)n2cnnc2c1

BDBM50548379

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)C1(CC#N)CN(CC(F)(F)F)C1

BDBM50548380

CCN1CC(CC#N)(C1)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C)c1

BDBM50548381

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)C1(CC#N)CN(CC2CC2)C1

BDBM50548382

CC(=O)N1CC(CC#N)(C1)n1cc(cn1)-c1nc(cn2nccc12)-c1cnn(C)c1

BDBM50548383

Cn1cc(cn1)-c1cn2nccc2c(n1)-c1cnn(c1)C1(CC#N)CN(CCO)C1

BDBM50551329

COCCn1cc(Nc2nccc(n2)-c2cccc(NC(=O)C=C)c2)cn1

BDBM50551330

C=CC(=O)Nc1cccc(c1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1

BDBM50551331

COCCn1cc(Nc2cc(ncn2)-c2ccc(NC(=O)C=C)cc2)cn1

BDBM50551320

COCCn1cc(Nc2nccc(n2)-c2ccc(NC(=O)C=C)cc2)cn1

BDBM50551321

C=CC(=O)Nc1ccc(cc1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1

BDBM50551335

COCCn1cc(Nc2cc(ncn2)-c2cccc(NC(=O)\C=C\C)c2)cn1

BDBM50551336

COCCn1cc(Nc2cc(ncn2)-c2cccc(NC(=O)CC#N)c2)cn1

BDBM50551337

C\C=C\C(=O)Nc1cccc(c1)-c1cc(Nc2ccc(cc2)N2CCOCC2)ncn1

BDBM50551350

C\C=C\C(=O)Nc1cccc(c1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1

BDBM50311014

O=C(CC#N)Nc1cccc(c1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1

BDBM50551352

COCCn1cc(Nc2cc(ncn2)-c2ccc(NC(=O)CC#N)cc2)cn1

BDBM50551355

COCCn1cc(Nc2nccc(n2)-c2ccc(NC(=O)\C=C\C)cc2)cn1

BDBM50551356

COCCn1cc(Nc2nccc(n2)-c2ccc(NC(=O)CC#N)cc2)cn1

BDBM50551322

C\C=C\C(=O)Nc1ccc(cc1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1

BDBM50311016

O=C(CC#N)Nc1ccc(cc1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1

BDBM50552007

C[C@H](CO)n1cnnc1-c1cccc(NC(=O)Nc2cc3ccccn3n2)n1 |r|

BDBM50095964

NC(=O)c1cnc2[nH]ccc2c1NC1CCN(Cc2ccccc2)CC1

BDBM50557209

CNC(=O)c1cnc2[nH]ccc2c1NC1CCN(Cc2ccccc2)CC1

BDBM50557210

CNC(=O)c1cnc2[nH]ccc2c1NC1CCN(Cc2ccccc2OC)CC1

BDBM50557207

CNC(=O)c1cnc2[nH]ccc2c1NC1CCN(Cc2cccc(OC)c2)CC1

BDBM50557212

CNC(=O)c1cnc2[nH]ccc2c1NC1CCN(Cc2cccc(c2)C#N)CC1

BDBM50557213

O=C(NC1CC1)c1cnc2[nH]ccc2c1NC1CCN(Cc2ccccc2)CC1

BDBM50557214

COc1cccc(CN2CCC(CC2)Nc2c(cnc3[nH]ccc23)C(=O)NC2CC2)c1

BDBM50557216

COc1cccc(CN2CCC(CC2)Nc2c(cnc3[nH]ccc23)C(=O)NC2CCCC2)c1

BDBM50557220

CNC(=O)c1cnc2[nH]ccc2c1NCC1CCN(Cc2ccc(Cl)cc2)CC1

BDBM50557222

CNC(=O)c1cnc2[nH]ccc2c1NCC1CCN(Cc2ccc(OC)cc2)CC1

BDBM50557224

CNC(=O)c1cnc2[nH]ccc2c1NC1CCN(Cc2cccc(Cl)c2)C1

BDBM50557225

CNC(=O)c1cnc2[nH]ccc2c1NC1CCN(Cc2ccc(Cl)cc2)C1

BDBM50557229

CNC(=O)c1cnc2[nH]ccc2c1NC1CC2CCC(C1)N2Cc1cccc(Cl)c1 |TLB:22:21:14.15.20:17.18|

BDBM50557230

CNC(=O)c1cnc2[nH]ccc2c1NC1CC2CCC(C1)N2Cc1ccc(Cl)cc1 |TLB:22:21:14.15.20:17.18|

BDBM50557231

CNC(=O)c1cnc2[nH]ccc2c1NC1CC2CCC(C1)N2Cc1cccc(OC)c1 |TLB:22:21:14.15.20:17.18|

BDBM50557232

CNC(=O)c1cnc2[nH]ccc2c1NC1CC2CCC(C1)N2Cc1ccc(OC)cc1 |TLB:22:21:14.15.20:17.18|

BDBM50557233

CNC(=O)c1cnc2[nH]ccc2c1NC1CC2CCC(C1)N2Cc1ccc(cc1)C#N |TLB:22:21:14.15.20:17.18|

BDBM50557234

CNC(=O)c1cnc2[nH]ccc2c1NC1CCCN(Cc2ccccc2)CC1

BDBM50557235

CNC(=O)c1cnc2[nH]ccc2c1NC1CCCN(Cc2cccc(Cl)c2)CC1

BDBM50557236

CNC(=O)c1cnc2[nH]ccc2c1NC1CCCN(Cc2ccc(Cl)cc2)CC1

BDBM50557237

CNC(=O)c1cnc2[nH]ccc2c1NC1CCCN(Cc2cccc(OC)c2)CC1

BDBM50557238

CNC(=O)c1cnc2[nH]ccc2c1NC1CCCN(Cc2ccc(OC)cc2)CC1

BDBM50557239

CNC(=O)c1cnc2[nH]ccc2c1NC1CCCN(Cc2ccc(cc2)C#N)CC1

BDBM50557240

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 |r|

BDBM50557241

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2cccc(Cl)c2)[C@@H](C)C1 |r|

BDBM50557242

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2ccc(Cl)cc2)[C@@H](C)C1 |r|

BDBM50557243

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2cccc(OC)c2)[C@@H](C)C1 |r|

BDBM50557244

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2ccc(OC)cc2)[C@@H](C)C1 |r|

BDBM50557245

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2cccc(Cl)c2)[C@H](C)C1 |r|

BDBM50557246

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2ccc(Cl)cc2)[C@H](C)C1 |r|

BDBM50557247

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2cccc(OC)c2)[C@H](C)C1 |r|

BDBM50557248

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2ccc(OC)cc2)[C@H](C)C1 |r|

BDBM50557249

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2ccc(cc2)C#N)[C@H](C)C1 |r|

BDBM50557250

C[C@@H]1C[C@@H](CCN1Cc1cccc(Cl)c1)Nc1c(cnc2[nH]ccc12)C(N)=O |r|

BDBM50557251

COc1cccc(CN2CC[C@H](C[C@H]2C)Nc2c(cnc3[nH]ccc23)C(N)=O)c1 |r|

BDBM50557252

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2cccc(Cl)c2)C[C@H]1F |r|

BDBM50557253

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2cccc(OC)c2)C[C@H]1F |r|

BDBM50557254

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2cccc(OC)c2)C[C@@H]1F |r|

BDBM50557255

CNC(=O)c1cnc2[nH]ccc2c1N[C@H]1CCN(Cc2ccc(Cl)cc2)[C@@H](C)C1 |r|

BDBM50557482

Cn1cc(Nc2nccc(n2)N2CC3CCC(C2)N3C(=O)[C@@H]2CC2(F)F)cn1 |r|

BDBM50557483

[H][C@]12C[C@]([H])(C[C@H](CC1)Nc1nc(Nc3cc(C)[nH]n3)cc3ncccc13)N2CCC#N |r,TLB:28:27:2:8.6.7.5|

BDBM107057

CC(C)Oc1cc(C2CCN(C)CC2)c(C)cc1Nc1nc(Nc2ccccc2S(=O)(=O)C(C)C)c2c(C)[nH]nc2n1

BDBM50559292

CC(C)n1cc(cn1)-c1nc(Nc2ccc3CCN(Cc3c2)C(=O)\C=C\CN(C)C)ncc1C

BDBM50559293

CC(C)n1cc(cn1)-c1nc(Nc2ccc3CCN(Cc3c2)C(=O)\C=C\C(=O)c2ccc(C)cc2)ncc1C

BDBM50559295

CC(C)n1cc(cn1)-c1nc(Nc2ccc3CCN(Cc3c2)C(=O)\C=C\C(=O)c2ccccc2)ncc1C

BDBM50559284

CC(C)n1cc(cn1)-c1nc(Nc2ccc3CN(CCc3c2)C(=O)\C=C\CN(C)C)ncc1C

BDBM50559282

CC(C)n1cc(cn1)-c1nc(Nc2ccc3CN(CCc3c2)C(=O)\C=C\C(=O)c2ccc(C)cc2)ncc1C

BDBM50559281

CC(C)n1cc(cn1)-c1nc(Nc2ccc3CN(CCc3c2)C(=O)\C=C\C(=O)c2ccccc2)ncc1C

BDBM50559279

COC(=O)\C=C\CN1CCc2cc(Nc3ncc(C)c(n3)-c3cnn(c3)C(C)C)ccc2C1

BDBM50559275

CC(C)n1cc(cn1)-c1nc(Nc2ccc3CN(CC#N)CCc3c2)ncc1C

BDBM50565963

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ccccn2)c1OC

BDBM50565964

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2cccnn2)c1OC

BDBM50565965

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ccncn2)c1OC

BDBM500294

CNC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2cnccn2)c1OC

BDBM500292

CNC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ncccn2)c1OC

BDBM50565966

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ncc(C)cn2)c1OC

BDBM50565967

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ncc(F)cn2)c1OC

BDBM50565968

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ncc(OC)cn2)c1OC

BDBM50565969

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2nccc(C)n2)c1OC

BDBM50565970

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2nccc(OC)n2)c1OC

BDBM50565971

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ncc(cn2)C(C)(C)O)c1OC

BDBM50565972

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ncc(cn2)C(=O)N(C)C)c1OC

BDBM50565973

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(c1OC)-c1ncc(cn1)C(C)(O)C(F)(F)F

BDBM50565974

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ncc(cn2)C(=O)N(CC)CC)c1OC

BDBM50565975

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cc(F)cc(c1OC)-c1ncc(cn1)C(C)(C)O

BDBM50565976

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cc(F)cc(-c2ncc(cn2)C(=O)N(C)C)c1OC

BDBM50565977

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2cnc(cn2)C(C)(C)O)c1OC

BDBM50565978

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2cnc(cn2)C(=O)N(C)C)c1OC

BDBM50565979

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ccc(cn2)C(C)(C)O)c1OC

BDBM50565980

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ccc(cn2)C(=O)N(C)C)c1OC

BDBM50565981

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ccc(nn2)C(C)(C)O)c1OC

BDBM50565982

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ccc(nn2)C(=O)N(C)C)c1OC

BDBM50565983

[2H]C([2H])([2H])NC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ncccn2)c1OC

BDBM50565984

[2H]C([2H])([2H])NC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cccc(-c2cnc(C)cn2)c1OC

BDBM50565985

[2H]C([2H])([2H])NC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cccc(-c2cnc(OC)cn2)c1OC

BDBM50565986

[2H]C([2H])([2H])NC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cccc(-c2ncc(F)cn2)c1OC

BDBM50565987

[2H]C([2H])([2H])NC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cc(F)cc(-c2ncccn2)c1OC

BDBM50567733

N#CCCn1cc(cn1)-n1c(cc2cnc3[nH]ccc3c12)-c1cccs1

BDBM50567735

N#CCCCn1cc(cn1)-n1ccc2cnc3[nH]ccc3c12

BDBM50567737

Cc1ccc(s1)-c1cc2cnc3[nH]ccc3c2n1-c1cnn(CCCC#N)c1

BDBM50570681

COc1cc(Nc2nc(NCc3cccc(NC(=O)CCl)c3)n3ccnc3c2C(N)=O)cc(OC)c1

BDBM50571706

CNC(=O)c1ccc(Nc2ncc(c(NCc3ccccc3Cl)n2)C(F)(F)F)cc1

BDBM50571721

CNC(=O)c1ccc(Nc2ncc(c(Nc3ccccc3OC)n2)C(F)(F)F)cc1

BDBM418817

CNC(=O)c1ccc(cc1)Nc2ncc(c(n2)NCc3c(nccn3)N(C)S(=O)(=O)C)C(F)(F)F

BDBM50505817

CC(C)n1cc(cn1)-c1nc(Nc2ccc(N3CCC(CC3)N(C)CCO)c(F)c2)ncc1C

BDBM50572359

CC(C)n1cc(cn1)-c1nc(Nc2ccc(NS(=O)(=O)c3ccc(cc3)C(F)(F)F)c(F)c2)ncc1C

BDBM50572360

CCS(=O)(=O)N1CCc2cc(Nc3ncc(C)c(n3)-c3cnn(c3)C(C)C)ccc12

BDBM50572361

CCCS(=O)(=O)N1CCc2cc(Nc3ncc(C)c(n3)-c3cnn(c3)C(C)C)ccc12

BDBM50572362

CC(C)n1cc(cn1)-c1nc(Nc2ccc3N(CCc3c2)S(=O)(=O)C2CC2)ncc1C

BDBM50572363

COc1ccc(cc1)S(=O)(=O)N1CCc2cc(Nc3ncc(C)c(n3)-c3cnn(c3)C(C)C)ccc12

BDBM50572364

CC(C)n1cc(cn1)-c1nc(Nc2ccc3N(CCc3c2)S(=O)(=O)c2ccc(cc2)C(F)(F)F)ncc1C

BDBM50572365

CC(C)n1cc(cn1)-c1nc(Nc2ccc3N(CCc3c2)S(=O)(=O)c2ccc3NC(=O)Cc3c2)ncc1C

BDBM50572366

CC(C)n1cc(cn1)-c1nc(Nc2ccc3N(CCc3c2)S(=O)(=O)c2ccc3N(C)C(=O)Cc3c2)ncc1C

BDBM50572367

CC(C)n1cc(cn1)-c1nc(Nc2ccc3N(CCc3c2)C(C)=O)ncc1C

BDBM50572368

CC(C)n1cc(cn1)-c1nc(Nc2ccc3N(CCc3c2)C(=O)C2CC2)ncc1C

BDBM50572369

CC(C)n1cc(cn1)-c1nc(Nc2ccc3N(CCc3c2)C(=O)C2CC2(F)F)ncc1C

BDBM50572370

CC(C)n1cc(cn1)-c1nc(Nc2ccc3N(CCc3c2)C(=O)[C@@H]2C[C@@H]2F)ncc1C |r|

BDBM50572371

CC(C)n1cc(cn1)-c1nc(Nc2ccc3N(CCc3c2)C(=O)c2ccc(cc2F)C(F)(F)F)ncc1C

BDBM50572372

CC(C)n1cc(cn1)-c1nc(Nc2ccc3N(CCc3c2)C(=O)c2cccc(c2)C(F)(F)F)ncc1C

BDBM50572373

CC(C)n1cc(cn1)-c1nc(Nc2ccc3N(CCc3c2)C(=O)Cc2ccc(OC(F)(F)F)cc2)ncc1C

BDBM50572374

CC(C)n1cc(cn1)-c1nc(Nc2ccc3N(CCc3c2)C(=O)CN2CCS(=O)(=O)CC2)ncc1C

BDBM50572375

CC(C)n1cc(cn1)-c1nc(Nc2ccc3N(CCc3c2)C(=O)CCN2CCOCC2)ncc1C

BDBM50572376

CC(C)n1cc(cn1)-c1nc(Nc2ccc3N(CCc3c2)C(=O)[C@H]2CCCN2)ncc1C |r|

BDBM50572377

CC(C)n1cc(cn1)-c1nc(Nc2ccc3N(CCc3c2)C(=O)[C@H]2CCCN2C(=O)C2(CC2)C#N)ncc1C |r|

BDBM50572378

CC(C)n1cc(cn1)-c1nc(Nc2ccc3N(CCc3c2)C(=O)[C@@H](O)CO)ncc1C |r|

BDBM50572379

Cc1cnc(Nc2ccc3N(CCc3c2)S(=O)(=O)c2ccc(cc2)C(F)(F)F)nc1-c1cnn(C)c1

BDBM50572380

CCCn1cc(cn1)-c1nc(Nc2ccc3N(CCc3c2)S(=O)(=O)c2ccc(cc2)C(F)(F)F)ncc1C

BDBM50572381

Cc1cnc(Nc2ccc3N(CCc3c2)S(=O)(=O)c2ccc(cc2)C(F)(F)F)nc1-c1cnn(c1)C1CC1

BDBM50572382

Cc1cnc(Nc2ccc3N(CCc3c2)S(=O)(=O)c2ccc(cc2)C(F)(F)F)nc1-c1cnn(c1)C1CCC1

BDBM50572383

Cc1cnc(Nc2ccc3N(CCc3c2)S(=O)(=O)c2ccc(cc2)C(F)(F)F)nc1-c1cnn(CCC#N)c1

BDBM50572384

CCOC(C)n1cc(cn1)-c1nc(Nc2ccc3N(CCc3c2)S(=O)(=O)c2ccc(cc2)C(F)(F)F)ncc1C

BDBM50572385

Fc1cnc(Nc2ccc3NCCc3c2)nc1-c1cnn(CCC#N)c1

BDBM50572386

Fc1cnc(Nc2ccc3C(=O)NCc3c2)nc1-c1cnn(CCC#N)c1

BDBM50572387

Cc1cnc(Nc2ccc3C(=O)NCc3c2)nc1-c1cnn(CCC#N)c1

BDBM50572388

Fc1cnc(Nc2ccc3N(CCc3c2)S(=O)(=O)C(F)(F)F)nc1-c1cnn(CCC#N)c1

BDBM50572389

Fc1cnc(Nc2ccc3N(CCc3c2)S(=O)(=O)c2ccc(cc2)C(F)(F)F)nc1-c1cnn(CCC#N)c1

BDBM50572390

Fc1cnc(Nc2ccc3N(CCc3c2)C(=O)c2ccc(cc2)C(F)(F)F)nc1-c1cnn(CCC#N)c1

BDBM50572391

CC(C)(C)c1ccc(cc1)C(=O)N1CCc2cc(Nc3ncc(F)c(n3)-c3cnn(CCC#N)c3)ccc12

BDBM50572392

Fc1cnc(Nc2ccc3N(CCc3c2)C(=O)CN2CCS(=O)(=O)CC2)nc1-c1cnn(CCC#N)c1

BDBM50572393

Fc1cnc(Nc2ccc3N(CCc3c2)C(=O)C2(CC2)C#N)nc1-c1cnn(CCC#N)c1

BDBM50572394

Cn1ccc2cc(Nc3ncc(F)c(n3)-c3cnn(CCC#N)c3)ccc12

BDBM50572395

Fc1cnc(Nc2ccc3n(ccc3c2)S(=O)(=O)C(F)(F)F)nc1-c1cnn(CCC#N)c1

BDBM50572396

Fc1cnc(Nc2ccc3n(ccc3c2)C(=O)C2CC2)nc1-c1cnn(CCC#N)c1

BDBM50577169

CCN1CCN(CC1)c1ccc(Nc2ncc3scc(-c4cccc(NS(C)(=O)=O)c4)c3n2)cc1

BDBM50582343

ONC(=O)CCCCCn1cc(Nc2ncc3ccn(Cc4cccc(F)c4)c3n2)cn1

BDBM50582345

ONC(=O)CCCCCn1cc(Nc2ncc3ccn(Cc4ccccc4F)c3n2)cn1

BDBM50582347

ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(Cc4cccc(F)c4)c3n2)cn1

BDBM50582348

ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(-c4ccccc4)c3n2)cn1

BDBM50582354

ONC(=O)CCCCCCn1cc(Nc2ncc3ccn(Cc4ccccc4F)c3n2)cn1

BDBM50583424

Cc1cnc(Nc2ccccc2)nc1N1CCC2(CCNC2=O)CC1

BDBM50583425

Cc1cnc(Nc2cnn(C)c2)nc1N1CCC2(CC1)NC(=O)NC2=O

BDBM50583426

Cc1cnc(Nc2cnn(C)c2)nc1N1C2CCC1COC2

BDBM50583427

Cc1cnc(Nc2cnn(C)c2)nc1N1CCC2(CCNC2=O)CC1

BDBM50583428

Cn1cc(Nc2nccc(n2)N2CCC3(CCNC3=O)CC2)cn1

BDBM50583429

COc1ccc(Nc2ncc(C)c(n2)N2CCC3(CCNC3=O)CC2)cc1

BDBM50583430

COc1ccc(Nc2ncc(C)c(n2)N2CCC3(CCNC3=O)CC2)cc1OC

BDBM50583431

Cc1cnc(Nc2ccc(cc2)[N+]([O-])=O)nc1N1CCC2(CCNC2=O)CC1

BDBM50583432

COc1ccc(Nc2ncc(C)c(n2)N2CCC3(CCNC3=O)CC2)cc1N

BDBM50583433

COc1cc(Nc2ncc(C)c(n2)N2CCC3(CCNC3=O)CC2)cc(OC)c1OC

BDBM50583434

Cc1cnc(Nc2ccc(F)cc2)nc1N1CCC2(CCNC2=O)CC1

BDBM50583435

Cc1cnc(Nc2ccc(cc2)C(C)(C)C)nc1N1CCC2(CCNC2=O)CC1

BDBM50583436

Cc1cnc(Nc2ccc(cc2)C(F)(F)F)nc1N1CCC2(CCNC2=O)CC1

BDBM50583437

COc1ccc(Nc2ncc(C)c(n2)N2CCC3(CCNC3=O)CC2)cc1F

BDBM50583438

Cc1cnc(Nc2ccc(F)c(N)c2)nc1N1CCC2(CCNC2=O)CC1

BDBM50583439

Cc1cnc(Nc2ccncc2)nc1N1CCC2(CCNC2=O)CC1

BDBM50583440

Cc1cnc(Nc2nccs2)nc1N1CCC2(CCNC2=O)CC1

BDBM50583441

CC(C)n1cc(Nc2ncc(C)c(n2)N2CCC3(CCNC3=O)CC2)cn1

BDBM50583442

Cc1cnc(Nc2cnn(c2)C(F)F)nc1N1CCC2(CCNC2=O)CC1

BDBM50583443

Cc1cnc(Nc2ccc(cc2)N2CCOCC2)nc1N1CCC2(CCNC2=O)CC1

BDBM50583444

Cc1cnc(Nc2ccc(N3CCOCC3)c(F)c2)nc1N1CCC2(CCNC2=O)CC1

BDBM50583445

CC(=O)N1CCN(CC1)c1ccc(Nc2ncc(C)c(n2)N2CCC3(CCNC3=O)CC2)cc1

BDBM50583446

CC1CN(CCO1)c1ccc(Nc2ncc(C)c(n2)N2CCC3(CCNC3=O)CC2)cc1

BDBM50583447

Cc1cnc(Nc2ccc(OCCN3CCCC3)cc2)nc1N1CCC2(CCNC2=O)CC1

BDBM50583448

Cc1cnc(Nc2ccc(cc2)N2C3CCC2COC3)nc1N1CCC2(CCNC2=O)CC1

BDBM50585189

NS(=O)(=O)c1ccc(CNc2nc(Nc3cccc(CN4CCOCC4)c3)ncc2Br)cc1

BDBM50585191

NS(=O)(=O)c1ccc(CNc2nc(Nc3cccc(NC(=O)N4CCCC4)c3)ncc2Br)cc1

BDBM50585194

NS(=O)(=O)c1ccc(CNc2ccnc(Nc3cccc(NC(=O)N4CCCC4)c3)n2)cc1

BDBM50585186

O=C(NCCCNc1ccnc(Nc2cccc(NC(=O)N3CCCC3)c2)n1)C1CCC1

BDBM50585195

NS(=O)(=O)c1ccc(CNc2ccnc(Nc3cccc(CN4CCOCC4)c3)n2)cc1

BDBM50585520

Cn1cc(Nc2ncc3cccc(OC4CCNCC4)c3n2)cn1

BDBM50585521

CC(=O)N1CCC(CC1)Oc1cccc2cnc(Nc3cnn(C)c3)nc12

BDBM50585522

COc1cccc2cnc(Nc3cnn(C)c3)nc12

BDBM50585523

Cn1cc(Nc2ncc3cccc(CC4CCNCC4)c3n2)cn1

BDBM50585524

CC(=O)N1CCC(Cc2cccc3cnc(Nc4cnn(C)c4)nc23)CC1

BDBM50585525

Cn1cc(Nc2ncc3cccc(NC4CCNCC4)c3n2)cn1

BDBM50585526

CC(=O)N1CCC(CC1)Nc2cccc3c2nc(nc3)Nc4cnn(c4)C

BDBM50585527

COc1cc(cc2cnc(Nc3cnn(C)c3)nc12)-c1ccc(O)cc1

BDBM50585498

COc1cc(cc2cnc(N)nc12)-c1ccc(O)cc1

BDBM50585499

CCc1c(F)c(O)ccc1-c1cc(OC)c2nc(N)ncc2c1

BDBM50585500

CCc1cc(O)c(F)cc1-c1cc(OC)c2nc(N)ncc2c1

BDBM50585501

CCc1cc(O)c(F)cc1-c1cc(NC2CCN(CC2)C(C)=O)c2nc(N)ncc2c1

BDBM50585502

CCc1cc(O)c(F)cc1-c1cc(NCCO)c2nc(N)ncc2c1

BDBM50585503

CCc1cc(O)c(F)cc1-c1cc(N(C)CCO)c2nc(N)ncc2c1

BDBM50585504

CCc1cc(O)c(F)cc1-c1cc(NCCCO)c2nc(N)ncc2c1

BDBM50585505

CCc1cc(O)c(F)cc1-c1cc(N[C@@H](C)CO)c2nc(N)ncc2c1 |r|

BDBM50585506

CCc1cc(O)c(F)cc1-c1cc(N[C@H](C)CO)c2nc(N)ncc2c1 |r|

BDBM50585507

CCc1cc(O)c(F)cc1-c1cc(NC[C@H](C)O)c2nc(N)ncc2c1 |r|

BDBM50585508

CCc1cc(O)c(F)cc1-c1cc(NC[C@@H](C)O)c2nc(N)ncc2c1 |r|

BDBM50585509

CCc1cc(O)c(F)cc1-c1cc(NC(CO)CO)c2nc(N)ncc2c1

BDBM50585510

CCc1cc(O)c(F)cc1-c1cc(NCCNC)c2nc(N)ncc2c1

BDBM50585511

CCc1cc(O)c(F)cc1-c1cc(NC2CCN(C)CC2)c2nc(N)ncc2c1

BDBM50585512

CCc1cc(O)c(F)cc1-c1cc(NCC2CCN(C)CC2)c2nc(N)ncc2c1

BDBM50585513

CCc1cc(O)c(F)cc1-c1cc(N[C@@H]2CCCN(C)C2)c2nc(N)ncc2c1 |r|

BDBM50585514

CCc1cc(O)c(F)cc1-c1cc(N[C@H]2CCCN(C)C2)c2nc(N)ncc2c1 |r|

BDBM50585515

[H][C@]12CC[C@]([H])(C[C@@H](C1)Nc1cc(cc3cnc(N)nc13)-c1cc(F)c(O)cc1CC)N2 |r|

BDBM50585516

[H][C@]12CC[C@]([H])(C[C@H](C1)Nc1cc(cc3cnc(N)nc13)-c1cc(F)c(O)cc1CC)N2 |r|

BDBM50585517

CCc1cc(O)c(F)cc1-c1cc(N[C@@H](C)CO)c2nc(NCCCN(C)C)ncc2c1 |r|

BDBM50585518

CCc1cc(O)c(F)cc1-c1cc(N[C@@H](C)CO)c2nc(NCCOCCN(C)C)ncc2c1 |r|

BDBM50585519

CCc1cc(O)c(F)cc1-c1cc(N[C@@H](C)CO)c2nc(NCCCCCN(C)C)ncc2c1 |r|

BDBM50585528

CCc1cc(O)c(F)cc1-c1cc(N[C@@H](C)CO)c2[nH]c(N)nc(=O)c2c1 |r|

BDBM50589365

NC(=O)c1ccc(NC(=O)c2ccc[nH]c2=O)cc1

BDBM50589366

CC(C)c1nc(Nc2ccc(cc2)C(O)=O)c2c(cc[nH]c2=O)n1

BDBM50589367

NC(=O)c1cnc(nc1Nc1ccc(CC(O)=O)cc1)-c1c(F)cccc1F

BDBM50589368

Fc1cccc(F)c1-c1nc2CNC(=O)c2c(Nc2ccc(cc2)C2CCNC2=O)n1

BDBM50589369

Fc1cccc(F)c1-c1cc(Nc2ccc(cn2)C(=O)N2CCCC2)c2C(=O)NCc2n1

BDBM50589370

O[C@H]1CCN(C1)C(=O)c1ccc(Nc2cc(nc3CNC(=O)c23)-c2c(F)cccc2F)cc1 |r|

BDBM50593320

COc1cc(Nc2ncc(C)c(Nc3ccc4oc(=O)[nH]c4c3)n2)cc(C)c1F

BDBM50595818

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)C(N)=O)c1OC

BDBM50595819

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cn2)C(N)=O)c1OC

BDBM50595820

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2csc(c2)C(N)=O)c1OC

BDBM50595821

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)C(=O)NC)c1OC

BDBM50595822

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)C(=O)NCC)c1OC

BDBM50595823

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)C(=O)N(CC)CC)c1OC

BDBM50595824

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)C(=O)N2CCCC2)c1OC

BDBM50595825

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)C(=O)NC2CCCC2)c1OC

BDBM50595826

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)C(=O)N2C([2H])([2H])CCC2([2H])[2H])c1OC

BDBM50595827

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)C(=O)N2C3CCC2CC3)c1OC

BDBM50595828

[H][C@@]12C[C@]1([H])N([C@@H](C2)C#N)C(=O)c1ccc(NC(=O)c2cccc(Nc3cc(NC(=O)C4CC4)nnc3C(=O)NC([2H])([2H])[2H])c2OC)cc1 |r|

BDBM50595829

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)C(=O)N2CCSC2)c1OC

BDBM50595830

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(nc2)C(=O)N2CCCC2)c1OC

BDBM50595831

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(C(=O)N3CCCC3)c(F)c2)c1OC

BDBM50595832

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)NC2CCC(CC2)C(=O)N2CCCC2)c1OC |(-7.38,.27,;-7.38,-1.28,;-8.77,-2.06,;-8.77,-.5,;-6.05,-2.06,;-4.67,-1.28,;-4.67,.27,;-3.34,-2.06,;-3.34,-3.66,;-1.95,-4.44,;-.62,-3.66,;.76,-4.44,;2.09,-3.66,;2.09,-2.06,;3.48,-4.44,;5.03,-4.44,;4.25,-5.77,;-.62,-2.06,;-1.95,-1.28,;-1.95,.27,;-.62,1.05,;.76,.27,;2.09,1.05,;2.09,2.65,;.76,3.43,;.76,4.98,;-.62,5.76,;2.09,5.76,;3.43,4.99,;4.76,5.77,;6.09,5.01,;6.1,3.47,;4.78,2.69,;3.44,3.45,;7.43,2.7,;8.77,3.47,;7.43,1.16,;8.77,.39,;8.42,-1.15,;6.92,-1.3,;6.3,.12,;-.62,2.65,;-1.95,3.43,;-1.95,4.98,)|

BDBM50595833

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)S(=O)(=O)N2CCCC2)c1OC

BDBM50595834

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2ccccn2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)C(=O)N2CCCC2)c1OC

BDBM50595835

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2ccc(F)cn2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)C(=O)N2CCCC2)c1OC

BDBM50595836

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc3C(=O)NCc3c2)c1OC

BDBM50595837

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc3CNC(=O)c3c2)c1OC

BDBM50595838

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2cccc3CNC(=O)c23)c1OC

BDBM50595839

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc3C(=O)N(Cc3c2)C2CC2)c1OC

BDBM50595840

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc3NC(=O)Cc3c2)c1OC

BDBM50595841

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(NCC3CCOCC3)cc2)c1OC

BDBM50595842

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(NC[C@@H]3COCCO3)cc2)c1OC |r|

BDBM50595843

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(NC[C@H]3COCCO3)cc2)c1OC |r|

BDBM50595844

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2ccccn2)cc1Nc1cccc(C(=O)Nc2ccc(NC[C@H]3COCCO3)cc2)c1OC |r|

BDBM50595845

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cc(F)cc(C(=O)Nc2ccc(NC[C@H]3COCCO3)cc2)c1OC |r|

BDBM50598705

[H][C@]12OC[C@@H](Oc3nc(Nc4ccc(N5CCC(CC5)N5CCN(C)CC5)c(Cl)c4)ncc3Cl)[C@@]1([H])OC[C@@H]2O |r|

BDBM50600161

CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(Cc4cccc(NC(=O)C=C)c4)c3n2)cc1

BDBM50210177

C(CN1CCCC1)Oc1ccc2Nc3nccc(n3)-c3cccc(COC\C=C\COCc1c2)c3 |t:29|

BDBM50239780

COc1ccc2NC(=O)\C(=C3/Nc4ccccc4/C/3=N\OCC(O)CO)c2c1

BDBM50602417

O=C(Nc1nc2cccc(C3=CCN(CC3)C(=O)C3CC3)n2n1)C1CC1 |t:10|

BDBM50602422

FC1(F)C[C@@H]1C(=O)N[C@H]1CC[C@H](CC1)c1cccc2nc(NC(=O)C3CC3)nn12 |r,wU:11.15,8.8,wD:4.5,(7.32,4.03,;5.77,4.03,;6.55,5.36,;5.01,2.69,;4.23,4.03,;2.9,4.8,;2.9,6.34,;1.57,4.03,;1.57,2.49,;2.9,1.72,;2.9,.18,;1.57,-.59,;.23,.18,;.23,1.72,;1.57,-2.13,;2.89,-2.9,;2.89,-4.43,;1.57,-5.2,;.24,-4.44,;-1.23,-4.92,;-2.13,-3.67,;-3.67,-3.67,;-4.44,-5,;-3.67,-6.34,;-5.98,-5,;-7.32,-4.23,;-7.32,-5.77,;-1.23,-2.42,;.24,-2.9,)|

BDBM50602423

FC1(F)C[C@H]1C(=O)N[C@H]1CC[C@H](CC1)c1cccc2nc(NC(=O)C3CC3)nn12 |r,wU:11.15,8.8,4.5,(7.32,4.03,;5.77,4.03,;6.55,5.36,;5.01,2.69,;4.23,4.03,;2.9,4.8,;2.9,6.34,;1.57,4.03,;1.57,2.49,;2.9,1.72,;2.9,.18,;1.57,-.59,;.23,.18,;.23,1.72,;1.57,-2.13,;2.89,-2.9,;2.89,-4.43,;1.57,-5.2,;.24,-4.44,;-1.23,-4.92,;-2.13,-3.67,;-3.67,-3.67,;-4.44,-5,;-3.67,-6.34,;-5.98,-5,;-7.32,-4.23,;-7.32,-5.77,;-1.23,-2.42,;.24,-2.9,)|

BDBM50602424

FC1(F)C[C@@H]1C(=O)N[C@H]1CC[C@@H](CC1)c1cccc2nc(NC(=O)C3CC3)nn12 |r,wU:11.15,wD:8.8,4.5,(7.32,4.03,;5.77,4.03,;6.55,5.36,;5.01,2.69,;4.23,4.03,;2.9,4.8,;2.9,6.34,;1.57,4.03,;1.57,2.49,;.23,1.72,;.23,.18,;1.57,-.59,;2.9,.18,;2.9,1.72,;1.57,-2.13,;2.89,-2.9,;2.89,-4.43,;1.57,-5.2,;.24,-4.44,;-1.23,-4.92,;-2.13,-3.67,;-3.67,-3.67,;-4.44,-5,;-3.67,-6.34,;-5.98,-5,;-7.32,-4.23,;-7.32,-5.77,;-1.23,-2.42,;.24,-2.9,)|

BDBM50602425

FC1(F)C[C@H]1C(=O)N[C@H]1CC[C@@H](CC1)c1cccc2nc(NC(=O)C3CC3)nn12 |r,wU:11.15,4.5,wD:8.8,(7.32,4.03,;5.77,4.03,;6.55,5.36,;5.01,2.69,;4.23,4.03,;2.9,4.8,;2.9,6.34,;1.57,4.03,;1.57,2.49,;.23,1.72,;.23,.18,;1.57,-.59,;2.9,.18,;2.9,1.72,;1.57,-2.13,;2.89,-2.9,;2.89,-4.43,;1.57,-5.2,;.24,-4.44,;-1.23,-4.92,;-2.13,-3.67,;-3.67,-3.67,;-4.44,-5,;-3.67,-6.34,;-5.98,-5,;-7.32,-4.23,;-7.32,-5.77,;-1.23,-2.42,;.24,-2.9,)|

BDBM50602426

FC1(F)C[C@H]1C(=O)N1CCC2(CCC(CC2)c2cccc3nc(NC(=O)C4CC4)nn23)CC1 |r|

BDBM50602427

FC1(F)C[C@H]1C(=O)N1CCC2(C1)CCC(CC2)c1cccc2nc(NC(=O)C3CC3)nn12 |r|

BDBM50602428

FC1(F)C[C@@H]1C(=O)N1CCC2(C1)CCC(CC2)c1cccc2nc(NC(=O)C3CC3)nn12 |r|

BDBM50602431

O=C(CC#N)N1CCC2(C1)CCC(CC2)c1cccc2nc(NC(=O)C3CC3)nn12

BDBM50611955

CNS(=O)(=O)C[C@H]1CC[C@@H](CC1)N(C)c1[nH]cnc2nccc12 |r,wU:6.5,wD:9.12,(-10.18,.5,;-8.84,-.27,;-7.51,.5,;-8.28,1.83,;-6.42,1.58,;-6.17,-.27,;-4.84,.5,;-4.84,2.04,;-3.51,2.81,;-2.17,2.04,;-2.17,.5,;-3.51,-.27,;-.84,2.81,;-.84,4.35,;.49,2.04,;.49,.5,;1.83,-.27,;3.16,.5,;3.16,2.04,;4.31,3.07,;3.68,4.47,;2.15,4.31,;1.83,2.81,)|

BDBM50468574

CCS(=O)(=O)N1CCN(CC1)c2ccc(cc2)Nc3ncc(c(n3)NC4CC4)C(=O)N

BDBM246868

Fc1c(ccnc1C(F)(F)F)C(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12

BDBM128101

CC1(C)CN(C1)C(=O)c1ccc(cc1)-c1cccc2nc(NC(=O)C3CC3)nn12

BDBM50591313

Cc1cc(n[nH]1)Nc2cc(c3nc(c(n3n2)Cc4ccc(cc4F)Cl)C)CN5CCOCC5

BDBM50595922

C[C@H](Nc1cc(cc(Nc2cnccn2)n1)-c1cnn(C)c1)c1ccc(F)cc1 |r|

BDBM610463

CC1CN(CCO1)c1ccncc1NC(=O)c1ccnn2cc(nc12)-c1ccccc1

BDBM50613373

Cc1cccc(Nc2cc(Nc3ccccc3Cl)c(cn2)C(N)=O)n1

BDBM50613374

CCOC(=O)Oc1cccc(Nc2cc(Nc3ccccc3Cl)c(cn2)C(N)=O)n1

BDBM50613372

NC(=O)c1cnc(Nc2cccc(O)n2)cc1Nc1ccccc1Cl

BDBM50613375

NC(=O)c1cnc(Nc2ccc(O)cn2)cc1Nc1ccccc1Cl

BDBM50613376

COc1cccc(Nc2cc(Nc3ccccc3Cl)c(cn2)C(N)=O)n1

BDBM50613392

O=C(Nc1cc(ccn1)C(=O)Nc1cnccc1-c1ccccc1)C1CC1

BDBM50613393

Fc1ccc(cc1)-c1ccncc1NC(=O)c1ccnc(NC(=O)C2CC2)c1

BDBM50613394

Clc1ccc(cc1)-c1ccncc1NC(=O)c1ccnc(NC(=O)C2CC2)c1

BDBM50452728

COc1ccncc1NC(=O)c2ccnc(c2)NC(=O)C3CC3

BDBM50613968

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(NC(=O)C3CCCC3)cc2)c1OC

BDBM50613969

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)N2CCCC2=O)c1OC

BDBM50613970

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)N2CCCCC2=O)c1OC

BDBM50613971

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)N2CCCCCC2=O)c1OC

BDBM50613972

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2ccccn2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)N2CCCCC2=O)c1OC

BDBM50613973

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2ccc(F)cn2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)N2CCCCC2=O)c1OC

BDBM50613974

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2F)N2CCCCC2=O)c1OC

BDBM50613975

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(N3CCCCC3=O)c(Cl)c2)c1OC

BDBM50613976

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)N2CCCCS2(=O)=O)c1OC

BDBM50613977

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)N2CCCCC2)c1OC

BDBM50613978

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)C2CCCNC2=O)c1OC

BDBM50613979

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)-n2ccccc2=O)c1OC

BDBM50613980

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2cccc(c2)-n2ccccc2=O)c1OC

BDBM50613981

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)-c2cccc(=O)[nH]2)c1OC

BDBM50613982

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)-c2ccc(F)c(=O)[nH]2)c1OC

BDBM50613983

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)-n2cccn2)c1OC

BDBM50613984

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)-n2ccnc2)c1OC

BDBM50613985

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)-c2cccnc2)c1OC

BDBM50613986

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)-c2ncn(C)n2)c1OC

BDBM50613987

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)-c2ncn(CC)n2)c1OC

BDBM50613988

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(cc2)-c2ncn(n2)C2CC2)c1OC

BDBM50616841

NC(=O)c1cnc(Nc2ccccn2)cc1Nc1ccccc1Cl

BDBM50616840

COc1ccccc1Nc1cc(Nc2cccc(C)n2)ncc1C(N)=O

BDBM50616839

COc1ccccc1Nc1cc(Nc2cccnn2)ncc1C(N)=O

BDBM50616838

COc1ccccc1Nc1cc(Nc2ccccn2)ncc1C(N)=O

BDBM435794

CNc1cc(nc2n1ncc2C(=O)N[C@@H]3C[C@@H]3F)NC4=CC=CN(C4=O)c5c(cccn5)F

BDBM423689

CNc1cc(Nc2cccn(-c3ncccc3F)c2=O)nc2c(cnn12)C(=O)N[C@H]1C[C@H]1F |r|

BDBM424808

CNc1cc(Nc2cccn(-c3ncccc3F)c2=O)nc2c(cnn12)C(=O)N[C@H]1C[C@@H]1OC |r|

BDBM424807

CNc1cc(Nc2cccn(-c3ncccc3F)c2=O)nc2c(cnn12)C(=O)N[C@@H]1C[C@H]1OC |r|

BDBM565754

CNc1cc(Nc2cccn(-c3ncccc3F)c2=O)nc2c(cnn12)C(=O)N[C@H]1CCC1(F)F |r|

BDBM50618788

CNc1cc(Nc2cccn(-c3ncccc3F)c2=O)nc2c(cnn12)C(=O)N[C@@H]1CCC1(F)F |r|

BDBM424408

CNc1cc(Nc2cccn(-c3ncccc3F)c2=O)nc2c(cnn12)C(=O)N[C@@H]1CC[C@H]1OC |r|

BDBM424450

CNc1cc(Nc2cccn(-c3ncccc3F)c2=O)nc2c(cnn12)C(=O)N[C@H]1CC[C@@H]1OC |r|

BDBM424220

CNc1cc(Nc2cccn(-c3ncccc3F)c2=O)nc2c(cnn12)C(=O)N[C@H]1CC[C@@H]1O |r|

BDBM424321

CNc1cc(Nc2cccn(-c3ncccc3F)c2=O)nc2c(cnn12)C(=O)N[C@@H]1CC[C@H]1O |r|

BDBM424111

CNc1cc(Nc2cccn(-c3ncccc3F)c2=O)nc2c(cnn12)C(=O)N[C@@H]1CC[C@@H]1O |r|

BDBM424118

CNc1cc(Nc2cccn(-c3ncccc3F)c2=O)nc2c(cnn12)C(=O)N[C@H]1CC[C@H]1O |r|

BDBM565847

CNc1cc(Nc2cccn(-c3ncccc3F)c2=O)nc2c(cnn12)C(=O)N[C@@H]1CC[C@@]1(C)OC |r|

BDBM424040

CNc1cc(Nc2cccn(-c3ncccc3F)c2=O)nc2c(cnn12)C(=O)NC1CC2(COC2)C1

BDBM565510

CNc1cc(Nc2cccn(-c3ncccc3F)c2=O)nc2c(cnn12)C(=O)N[C@@H]1CC[C@H](C1)OC |r|

BDBM565511

CNc1cc(Nc2cccn(-c3ncccc3F)c2=O)nc2c(cnn12)C(=O)N[C@H]1CC[C@@H](C1)OC |r|

BDBM424086

CNc1cc(Nc2cccn(-c3ncccc3F)c2=O)nc2c(cnn12)C(=O)NCC1(CO)CC1

BDBM423409

CNc1cc(Nc2cc(C)cc(C)c2)nc2c(cnn12)C(=O)NC1CC1

BDBM423553

CNc1cc(nc2n1ncc2C(=O)NC3CC3)Nc4cccnc4OC

BDBM423652

CNc1cc(Nc2cccn(-c3ccc(F)cc3)c2=O)nc2c(cnn12)C(=O)NC1CC1

BDBM423688

CNc1cc(Nc2cccn(-c3ncccc3F)c2=O)nc2c(cnn12)C(=O)NC1CC1

BDBM424525

CNc1cc(Nc2cccn(C(C)C)c2=O)nc2c(cnn12)C(=O)N[C@H]1CC[C@@H]1OC |r|

BDBM424454

CNc1cc(Nc2cccn(-c3ccccn3)c2=O)nc2c(cnn12)C(=O)N[C@H]1CC[C@@H]1OC |r|

BDBM424362

CNc1cc(Nc2cccn(-c3ccc(F)cn3)c2=O)nc2c(cnn12)C(=O)N[C@@H]1CC[C@H]1OC |r|

BDBM424409

CNc1cc(Nc2cccn(-c3cccnc3)c2=O)nc2c(cnn12)C(=O)N[C@H]1CC[C@@H]1OC |r|

BDBM424410

CNc1cc(Nc2cccn(-c3cccnc3C)c2=O)nc2c(cnn12)C(=O)N[C@H]1CC[C@@H]1OC |r|

BDBM424388

CNc1cc(Nc2cccn(-c3ccc(C)nc3)c2=O)nc2c(cnn12)C(=O)N[C@H]1CC[C@@H]1OC |r|

BDBM424529

CNc1cc(Nc2cccn(-c3cncc(F)c3)c2=O)nc2c(cnn12)C(=O)N[C@H]1CC[C@@H]1OC |r|

BDBM424893

CNc1cc(Nc2cccn(-c3ncco3)c2=O)nc2c(cnn12)C(=O)N[C@H]1CC[C@@H]1OC |r|

BDBM424435

CNc1cc(Nc2cccn(-c3nc(C)co3)c2=O)nc2c(cnn12)C(=O)N[C@H]1CC[C@@H]1OC |r|

BDBM424440

CNc1cc(Nc2cccn(-c3cnc(C)o3)c2=O)nc2c(cnn12)C(=O)N[C@@H]1CC[C@H]1OC |r|

BDBM424815

CNc1cc(Nc2cccn(-c3ocnc3C)c2=O)nc2c(cnn12)C(=O)N[C@@H]1CC[C@H]1OC |r|

BDBM424559

CNc1cc(Nc2cccn(C3CCOCC3)c2=O)nc2c(cnn12)C(=O)N[C@H]1CC[C@@H]1OC |r|

BDBM424422

CNc1cc(Nc2cccn([C@H]3CCCOC3)c2=O)nc2c(cnn12)C(=O)N[C@H]1CC[C@@H]1OC |r|

BDBM424448

CNc1cc(Nc2cccn([C@@H]3CCCOC3)c2=O)nc2c(cnn12)C(=O)N[C@H]1CC[C@@H]1OC |r|

BDBM50618789

CNc1cc(Nc2cccn([C@@H]3CC[C@@H](CC3)OC)c2=O)nc2c(cnn12)C(=O)N[C@@H]1CC[C@H]1OC |r,wU:30.33,wD:11.10,33.38,14.17,(-3.78,4.23,;-2.45,3.46,;-2.45,1.92,;-1.13,1.16,;-1.13,-.38,;.21,-1.15,;1.54,-.38,;1.54,1.16,;2.87,1.93,;4.21,1.16,;4.21,-.37,;5.54,-1.14,;6.87,-.37,;8.21,-1.14,;8.21,-2.68,;6.87,-3.45,;5.54,-2.68,;9.54,-3.45,;10.87,-2.68,;2.88,-1.15,;2.88,-2.69,;-2.45,-1.14,;-3.78,-.38,;-5.24,-.86,;-6.15,.39,;-5.24,1.63,;-3.78,1.16,;-5.64,-2.35,;-4.55,-3.44,;-7.13,-2.75,;-8.22,-1.66,;-8.22,-.12,;-9.79,-.12,;-9.79,-1.66,;-10.87,-2.75,;-10.48,-4.23,)|

BDBM424662

CNc1cc(Nc2cccn(C3CCN(CCF)CC3)c2=O)nc2c(cnn12)C(=O)N[C@H]1CC[C@@H]1OC |r|

BDBM565687

CNc1cc(Nc2cccn([C@H]3C[C@@H](C3)OC)c2=O)nc2c(cnn12)C(=O)N[C@H]1CC[C@@H]1OC |r,wU:11.10,28.31,wD:31.36,13.15,(-.7,4.97,;.81,4.65,;1.28,3.19,;.25,2.05,;.73,.58,;-.3,-.56,;-1.81,-.24,;-2.29,1.22,;-3.79,1.54,;-4.82,.4,;-4.35,-1.07,;-5.38,-2.21,;-5.3,-3.75,;-6.83,-3.83,;-6.92,-2.29,;-7.86,-4.97,;-9.37,-4.65,;-2.84,-1.39,;-2.36,-2.85,;2.23,.26,;3.26,1.41,;4.8,1.41,;5.28,2.87,;4.03,3.78,;2.79,2.87,;5.57,.07,;4.8,-1.26,;7.11,.07,;7.88,-1.26,;9.37,-1.66,;8.97,-3.15,;7.49,-2.75,;6.15,-3.52,;4.82,-2.75,)|

BDBM565685

CNc1cc(Nc2cccn([C@@H]3C[C@@H](C3)OC)c2=O)nc2c(cnn12)C(=O)N[C@H]1CC[C@@H]1OC |r,wU:28.31,wD:11.10,31.36,13.15,(-.7,4.97,;.81,4.65,;1.28,3.19,;.25,2.05,;.73,.58,;-.3,-.56,;-1.81,-.24,;-2.29,1.22,;-3.79,1.54,;-4.82,.4,;-4.35,-1.07,;-5.38,-2.21,;-5.3,-3.75,;-6.83,-3.83,;-6.92,-2.29,;-7.86,-4.97,;-9.37,-4.65,;-2.84,-1.39,;-2.36,-2.85,;2.23,.26,;3.26,1.41,;4.8,1.41,;5.28,2.87,;4.03,3.78,;2.79,2.87,;5.57,.07,;4.8,-1.26,;7.11,.07,;7.88,-1.26,;9.37,-1.66,;8.97,-3.15,;7.49,-2.75,;6.15,-3.52,;4.82,-2.75,)|

BDBM565683

CNc1cc(Nc2cccn(C3COC3)c2=O)nc2c(cnn12)C(=O)N[C@H]1CC[C@@H]1OC |r|

BDBM50618790

Cc1ccn2ncc(C(=O)Nc3cc(Br)ccc3F)c2n1

BDBM50618791

CNc1ncnc2cc(sc12)-c1ccc(F)cc1

BDBM50618792

Cc1ccc(cc1)-n1ncc2c1nc([nH]c2=O)C1CC1

BDBM50619103

CC(C)n1cc(cn1)-c1nc(Nc2ccc(CNC(=O)\C=C\C(=O)c3ccccc3)cc2)ncc1C

BDBM50619105

CC(C)n1cc(cn1)-c1nc(Nc2ccc(CNC(=O)CCl)cc2)ncc1C

BDBM50619107

CC(C)n1cc(cn1)-c1nc(Nc2ccc(CNC(=O)C=C)cc2)ncc1C

BDBM50619108

CC(C)n1cc(cn1)-c1nc(Nc2ccc(CNC(=O)C3CC3)cc2)ncc1C

BDBM50619109

CC(C)n1cc(cn1)-c1nc(Nc2ccc(CNS(=O)(=O)C=C)cc2)ncc1C

BDBM50619110

CCS(=O)(=O)NCc1ccc(Nc2ncc(C)c(n2)-c2cnn(c2)C(C)C)cc1

BDBM50619113

CC(C)n1cc(cn1)-c1nc(Nc2ccc(CNS(=O)(=O)C3CC3)cc2)ncc1C

BDBM652829

CN(C)c1ccc(cc1)C(=O)Nc1ccc(c2OCOc12)-c1nn([C@@H]2CCCN(C2)C(=O)C=C)c2ncnc(N)c12 |r|

BDBM50620333

Cn1cc(Nc2nccc(n2)-c2cnn(CCC#N)c2)cn1

BDBM50620334

Cc1cnc(Nc2cnn(C)c2)nc1-c1cnn(CCC#N)c1

BDBM50620335

Cc1cc(Nc2ncc(C)c(n2)-c2cnn(CCC#N)c2)sn1

BDBM50620336

Cc1cc(Nc2ncc(Cl)c(n2)-c2cnn(CCC#N)c2)sn1

BDBM50620337

Cc1cc(Nc2cc(-c3cnn(CCC#N)c3)c(Cl)cn2)sn1

BDBM50620338

Cc1cnc(Nc2ccccc2)nc1-c1cnn(CCC#N)c1

BDBM50620339

Cc1cnc(NC2CCOCC2)nc1-c1cnn(CCC#N)c1

BDBM50620340

Cc1cnc(NCCN2CCOCC2)nc1-c1cnn(CCC#N)c1

BDBM50620341

Cc1cnc(Nc2ccc(cc2)N2CCOCC2)nc1-c1cnn(CCC#N)c1

BDBM50620342

CN1CCN(CC1)c1ccc(Nc2ncc(C)c(n2)-c2cnn(CCC#N)c2)cc1

BDBM50620343

Cc1cnc(Nc2cnn(C)c2)nc1-c1cnn(c1)[C@H](CC#N)C1CCCC1 |r|

BDBM50620344

Cc1cnc(Nc2cnn(C)c2)nc1N1CC2CCCC(C1)N2CCC#N |TLB:23:22:17.18.19:14.21.15,THB:13:14:22:17.18.19|

BDBM50622127

[H][C@@]12C[C@@]3([H])C[C@@](O)(C1)C[C@@]([H])(C2)[C@@H]3Nc1c(cnc2[nH]ccc12)-c1cn[nH]c1 |r,TLB:8:6:13:1.2.12,8:1:13:6.9.5,7:6:13:1.2.12,14:13:5:1.2.8,THB:12:1:13.10.9:5,12:10:5:1.2.8|

BDBM50622128

[H][C@]12CC3C[C@]([H])(CC(O)(C3)C1)C2Nc1c(cnc2[nH]ccc12)C(N)=O |r,TLB:10:3:12:7.8.11,10:8:12:2.3.4,4:5:11:2.3.10,THB:9:8:12:2.3.4,13:12:11:2.3.10,4:3:12.5.7:11|

BDBM50622457

Fc1ccc(cc1)-c1ccncc1NC(=O)c1ccnc(Nc2ccc(cc2)C#N)n1

BDBM50622458

Fc1ccc(Nc2nccc(n2)C(=O)Nc2cnccc2-c2ccc(F)cc2)cc1

BDBM50012188

O\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2cc(Br)ccc12

BDBM50623117

C[C@H]1CC(C(=O)CC#N)[C@]11CCN(C1)c1ncnc2[nH]ccc12 |r|

BDBM50595921

OC1CCN(CC1)c1ccc(Nc2nc(nc3cn[nH]c(=O)c23)N2CCC(CC#N)CC2)cc1

BDBM50623119

Brc1ccc2C(C(=O)Nc2c1)=C1Nc2ccccc2C1=N/OCCN1CCNCC1

BDBM50626161

[2H]C([2H])([2H])CC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cccc-2c1N(C)Cc1nc(C)nn-21

BDBM50626162

[2H]C([2H])([2H])CC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1nccc2-c3nn(C)nc3CN(C)c12

BDBM50626163

[2H]C([2H])([2H])CC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cccc2-c3nn(C)nc3C([2H])([2H])N(C)c12

BDBM50626164

[2H]C([2H])([2H])CC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1nccc2-c3nn(C)nc3C([2H])([2H])N(C)c12

BDBM50626165

[2H]C([2H])([2H])CC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cccc2-c3nn(nc3CN(C)c12)C([2H])([2H])[2H]

BDBM50626166

[2H]C([2H])([2H])CC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1nccc2-c3nn(nc3CN(C)c12)C([2H])([2H])[2H]

BDBM50626167

[2H]C([2H])([2H])CC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1nccc2-c3nn(CC)nc3CN(C)c12

BDBM50626168

[2H]C([2H])([2H])CC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cccc2-c3nn(C)nc3[C@H](C)N(C)c12 |r|

BDBM50626169

[2H]C([2H])([2H])CC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1nccc2-c3nn(C)cc3CN(C)c12

BDBM50626170

[2H]C([2H])([2H])CC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1cccc2-c3nn(C)cc3C([2H])([2H])N(C)c12

BDBM50626171

[2H]C([2H])([2H])CC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1nccc2-c3nn(C)cc3C([2H])([2H])N(C)c12

BDBM50626172

[2H]C([2H])([2H])CC(=O)c1cnc(NC(=O)C2CC2)cc1Nc1nccc2-c3nn(C)cc3[C@H](C)N(C)c12 |r|

BDBM50623925

CS(=O)(=O)N1CC[C@@H](C1)C#CC(=O)N1CCC[C@H](C1)c1ccc(Cl)c(Cl)c1 |r|

BDBM50170831

C1CCC(CC1)Nc1nc(Nc2ccc(cc2)N2CCOCC2)nc2nc[nH]c12

BDBM50627871

[O-][N+](=O)c1cccc(c1)-c1c([nH]n2c1nc(cc2=O)-c1ccccc1)C(F)(F)F

BDBM50243388

c1cc2c(cc1CN3CCOCC3)nc([nH]2)c4c(c[nH]n4)NC(=O)NC5CC5

BDBM51305

c1ccc(cc1)C2=CC(=O)N3C(=N2)C(=C(N3)C(F)(F)F)c4ccccc4

BDBM50627873

Fc1cccc(F)c1-c1ccc2[nH]cc(-c3cncc(O[C@@H]4CCCNC4)n3)c2c1 |r|

BDBM50627874

NC(=O)c1cnc2c(NC3CC3)cc(Nc3cc(cc(c3)C(F)(F)F)C#N)nn12

BDBM424361

CNc1cc(nc2n1ncc2C(=O)N[C@@H]3CC[C@H]3OC)NC4=CC=CN(C4=O)c5ccccn5

BDBM50627870

CNC(=O)c1nnc(NC(=O)C2CC2)c2[nH]c(cc12)-c1ccc(N)cc1OC

BDBM50628084

[2H]C([2H])([2H])NC(=O)c1nnc(NC(C)=O)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM50628085

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)CC)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM50628086

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)CCC)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM50628087

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM50628088

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CCC2)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM50628089

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)CC2CC2)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM50628090

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)OC)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM50628091

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2ccc(F)cc2)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM50628092

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2ccc(F)cn2)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM50628093

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2cccc(C)n2)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM50628094

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2cc(C)ccn2)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM50628095

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2cc(C)c(C)cn2)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM50628096

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2cccc(OC)n2)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM50628097

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2cc(OC)ccn2)cc1Nc1nccc(-c2ncn(C)n2)c1OC

BDBM50628098

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1nccc(-c2ccccn2)c1OC

BDBM50628099

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1nccc(-c2ncc(F)cn2)c1OC

BDBM50628100

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1nccc(-c2noc(C)n2)c1OC

BDBM50628101

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1nccc(-c2noc(CNC)n2)c1OC

BDBM50628102

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2ccccn2)cc1Nc1nccc(-c2ncc(F)cn2)c1OC

BDBM50628103

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2cc(F)ccn2)cc1Nc1nccc(-c2ncc(F)cn2)c1OC

BDBM50628104

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2cnc(C)cn2)cc1Nc1nccc(-c2ncc(F)cn2)c1OC

BDBM50628105

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2ccc(OC)nn2)cc1Nc1nccc(-c2ncc(F)cn2)c1OC

BDBM50628106

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2ccc(OCC)nn2)cc1Nc1nccc(-c2ncc(F)cn2)c1OC

BDBM50628107

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2ccc(cn2)N2CCOCC2)cc1Nc1nccc(c1OC)-c1ncc(F)cn1

BDBM50628108

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2ccc(cn2)C(C)(C)N)cc1Nc1nccc(-c2ncc(F)cn2)c1OC

BDBM50628109

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2ccc(cn2)C(C)(C)O)cc1Nc1nccc(-c2ncc(F)cn2)c1OC

BDBM50628110

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)CC)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM488779

COC[C@@H](N1CCN(C)CC1)C(=O)Nc1cccc2c(c[nH]c12)-c1nc(Nc2cccc(c2F)S(C)(=O)=O)ncc1F |r|

BDBM50630116

Cc1cnc(Nc2ccc(OCCN3CCCC3)cc2)nc1Nc1ccc(cc1)C(=O)NO

BDBM50630223

CN(C)S(=O)(=O)c1cccc(c1)-c1c[nH]c2cnc(NC(C)=O)cc12

BDBM50630224

CN(C)S(=O)(=O)c1cccc(c1)-c1c[nH]c2cnc(NC(=O)C3CC3)cc12

BDBM50630225

CN(C)S(=O)(=O)c1cccc(c1)-c1cn(C)c2cnc(NC(C)=O)cc12

BDBM50630226

CN(C)S(=O)(=O)c1cccc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12

BDBM50630227

CCS(=O)(=O)c1cccc(n1)-c1cn(C)c2cnc(NC(C)=O)cc12

BDBM50630228

CC(=O)Nc1cc2c(cn(C)c2cn1)-c1cccc(n1)S(=O)(=O)C1COC1

BDBM50630658

COC[C@@H](C)OC(=O)Cc1ccc(Nc2cc(Nc3ccccc3OC)c(cn2)C(N)=O)nc1 |r|

BDBM50630659

COC[C@H](C)OC(=O)Cc1ccc(Nc2cc(Nc3ccccc3OC)c(cn2)C(N)=O)nc1 |r|

BDBM50630660

COc1ccccc1Nc1cc(Nc2ccc(CC(O)=O)cn2)ncc1C(N)=O

BDBM50630661

CCOC(=O)c1ccc(Nc2cc(Nc3ccccc3Cl)c(cn2)C(N)=O)nc1

BDBM50630662

CCOC(=O)Cc1ccc(Nc2cc(Nc3ccccc3Cl)c(cn2)C(N)=O)nc1

BDBM50630663

CCOC(=O)CCc1ccc(Nc2cc(Nc3ccccc3Cl)c(cn2)C(N)=O)nc1

BDBM50630664

CCOC(=O)COc1ccc(Nc2cc(Nc3ccccc3Cl)c(cn2)C(N)=O)nc1

BDBM50630665

COC(=O)Cc1ccc(Nc2cc(Nc3ccccc3Cl)c(cn2)C(N)=O)nc1

BDBM50630666

CC(C)OC(=O)Cc1ccc(Nc2cc(Nc3ccccc3Cl)c(cn2)C(N)=O)nc1

BDBM50630667

NC(=O)c1cnc(Nc2ccc(CC(O)=O)cn2)cc1Nc1ccccc1Cl

BDBM50630668

CCOC(=O)Cc1ccc(Nc2cc(Nc3ccccc3OC)c(cn2)C(N)=O)nc1

BDBM50630669

COCCOC(=O)Cc1ccc(Nc2cc(Nc3ccccc3OC)c(cn2)C(N)=O)nc1

BDBM50630670

COc1ccccc1Nc1cc(Nc2ccc(CC(=O)O[C@@H]3CCOC3)cn2)ncc1C(N)=O |r|

BDBM50630671

COc1ccccc1Nc1cc(Nc2ccc(CC(=O)O[C@H]3CCOC3)cn2)ncc1C(N)=O |r|

BDBM50631275

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2cccc(c2)C#N)C[C@H]1F |r|

BDBM50631276

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2ccc(cc2)C#N)C[C@H]1F |r|

BDBM50631277

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2cccc(Cl)c2)C[C@@H]1F |r|

BDBM50631278

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2ccc(Cl)cc2)C[C@@H]1F |r|

BDBM50631279

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2ccc(OC)cc2)C[C@@H]1F |r|

BDBM50631280

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2cccc(c2)C#N)C[C@@H]1F |r|

BDBM50631281

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2ccc(cc2)C#N)C[C@@H]1F |r|

BDBM50631282

CNC(=O)c1cnc2[nH]ccc2c1NC1CCN(Cc2ccc(Cl)cc2)CC1(F)F

BDBM50631283

CNC(=O)c1cnc2[nH]ccc2c1NC1CCN(Cc2cccc(Cl)c2)C(C)(C)C1

BDBM50631284

CNC(=O)c1cnc2[nH]ccc2c1NC1CCN(Cc2ccc(Cl)cc2)C(C)(C)C1

BDBM50631285

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2ccccc2F)[C@H](C)C1 |r|

BDBM50631286

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2cccc(F)c2)[C@H](C)C1 |r|

BDBM50631287

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2ccc(F)cc2)[C@H](C)C1 |r|

BDBM50631288

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2ccc(cc2)C(F)(F)F)[C@H](C)C1 |r|

BDBM50631289

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2ccc(Cl)cn2)[C@H](C)C1 |r|

BDBM50631290

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2cccc(n2)C#N)[C@H](C)C1 |r|

BDBM50631291

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2ccc(cn2)C#N)[C@H](C)C1 |r|

BDBM50631292

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2ccc(cn2)C(F)(F)F)[C@H](C)C1 |r|

BDBM50631293

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2ccc(Cl)nc2)[C@H](C)C1 |r|

BDBM50631294

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2ccc(nc2)C#N)[C@H](C)C1 |r|

BDBM50631295

CNC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(Cc2ccc(nc2)C(F)(F)F)[C@H](C)C1 |r|

BDBM50631296

CNC(=O)c1cnc2[nH]ccc2c1N[C@H]1CCN(Cc2ccc(cc2)C(F)(F)F)[C@@H](C)C1 |r|

BDBM50631297

CNC(=O)c1cnc2[nH]ccc2c1N[C@H]1CCN(Cc2ccc(Cl)cn2)[C@@H](C)C1 |r|

BDBM50623116

COc1ccc2Nc3nccc(n3)-c3cccc(COC\C=C\COCc1c2)c3 |t:22|

BDBM50631767

Cc1cnc2Nc3ccc(OCCN4CCCC4)c(COC\C=C\COCc4cccc(c4)-c1n2)c3 |t:23|

BDBM50631768

COc1ccc-2cc1COC\C=C\COCc1cc(Nc3nccc-2n3)ccc1OCCN1CCCC1 |t:12|

BDBM50631769

OCCN1CCN(CC1)c1ccc2Nc3nccc(n3)-c3cccc(COC\C=C\COCc1c2)c3 |t:30|

BDBM50631770

CN(C)CCN(C)c1ccc2Nc3nccc(n3)-c3cccc(COC\C=C\COCc1c2)c3 |t:27|

BDBM50632564

Cn1cc(cn1)-c1cn2ncnc2c(n1)-c1ccn(c1)[C@@]1(CC#N)C[C@@H](C1)C#N |r,wU:20.23,wD:25.31,(4.57,-7.87,;4.07,-6.78,;2.54,-6.4,;2.43,-4.87,;3.85,-4.27,;4.89,-5.41,;1.12,-4.1,;-.25,-4.81,;-1.56,-4.05,;-3.03,-4.48,;-3.91,-3.23,;-2.98,-1.97,;-1.56,-2.46,;-.19,-1.75,;1.12,-2.52,;-.14,-.16,;1.12,.71,;.68,2.19,;-.9,2.19,;-1.39,.77,;-1.78,3.5,;-3.31,3.34,;-4.18,4.65,;-4.86,5.66,;-2.32,4.87,;-.85,5.36,;-.36,3.94,;-.19,6.78,;.3,7.87,)|

BDBM50632565

Cn1cc(cn1)-c1cn2ncnc2c(n1)-c1ccn(c1)[C@]1(CC#N)C[C@@H](C1)C#N |r,wU:20.23,25.31,(4.57,-7.88,;4.07,-6.78,;2.54,-6.4,;2.43,-4.87,;3.86,-4.27,;4.89,-5.41,;1.12,-4.1,;-.25,-4.81,;-1.56,-4.05,;-3.04,-4.48,;-3.91,-3.23,;-2.98,-1.97,;-1.56,-2.46,;-.19,-1.75,;1.12,-2.52,;-.14,-.16,;1.12,.71,;.68,2.19,;-.9,2.19,;-1.39,.77,;-1.78,3.5,;-3.31,3.34,;-4.18,4.65,;-4.86,5.66,;-.36,3.94,;-.85,5.36,;-2.32,4.87,;-.19,6.78,;.3,7.88,)|

BDBM50632566

NC(=O)c1nnc(cc1Nc1ccc(cc1)N1CCOCC1)-c1c(F)cccc1Cl

BDBM50632567

NC(=O)c1nnc(cc1Nc1ccc(cn1)N1CCOCC1=O)-c1c(F)cccc1F

BDBM50632568

NC(=O)c1nnc(cc1Nc1ccc(cn1)N1CCOCC1)-c1c(F)cccc1F

BDBM50632569

CNc1nc2sc(nc2c2n(C)cnc12)-c1cccc(c1)[C@@H](C)NC(=O)c1ccccc1S(C)(=O)=O |r|

BDBM50632570

CNc1cc(Nc2ccccc2OC)nc2c(cnn12)C(=O)N[C@@H]1CCN(C)C1=O |r|

BDBM50632571

CNc1cc(Nc2cccc3CCCOc23)nc2c(cnn12)C(=O)N[C@@H]1CCN(C)C1=O |r|

BDBM50632572

CNc1cc(Nc2cccn(-c3ccccn3)c2=O)nc2c(cnn12)C(=O)N[C@@H]1CCN(C)C1=O |r|

BDBM50632573

CCOc1cccc(Nc2cc(NC)n3ncc(C(=O)N[C@@H]4CCN(C)C4=O)c3n2)n1 |r|

BDBM423640

CNc1cc(Nc2cccn(-c3cnc(cn3)C(C)(C)O)c2=O)nc2c(cnn12)C(=O)NC1CCC1

BDBM423970

CNc1cc(Nc2cccnc2OC)nc2c(cnn12)C(=O)NCC1(CO)CC1

BDBM424705

CNc1cc(Nc2cccn(C3CC(F)(F)C3)c2=O)nc2c(cnn12)C(=O)N[C@@H]1CCC[C@@H](O)C1 |r|

BDBM566439

CNc1cc(nc2c(cnn12)C(=O)N[C@@H]1CC[C@H]1OC)-c1cn(C(C)C)c2nnccc12 |r|

BDBM566432

CNc1cc(nc2c(cnn12)C(=O)N[C@H]1CC[C@@H]1OC)-c1cnc2n(cccc12)[C@H]1CCOC1 |r|

BDBM50632575

[2H]C([2H])([2H])O[C@@H]1CC[C@@H]1NC(=O)c1cnn2c(NC)cc(Nc3cccn(-c4ncccc4F)c3=O)nc12 |r|

BDBM50632576

[2H]C([2H])([2H])NC(=O)c1nnc(Nc2ccc(cn2)N2CC(O)C2)cc1Nc1cccc(-c2ncn(C)n2)c1OC

BDBM50632577

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(c1OC)-n1cc2CN(Cc2n1)S(C)(=N)=O

BDBM50632578

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(-c2noc(CN3CCN(CC3)S(C)(=N)=O)n2)c1OC

BDBM50632581

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1ncc(cc1S(C)(=O)=O)C1CC1

BDBM50632582

[2H]C([2H])([2H])NC(=O)c1nnc(NC(=O)[C@H]2CC22CC2)cc1Nc1ncc(OCCOC)cc1S(C)(=O)=O |r|

BDBM50632579

CNc1cc2Nc3cc(COC[C@@H](C)NC(=O)c4cnc1n4n2)ccc3OC |r|

BDBM50632583

[H][C@@]12CCC[C@@]1([H])OCc1cc(Nc3cc(NC)c4ncc(C(=O)N2)n4n3)c2nnn(c2c1)C([2H])([2H])[2H] |r|

BDBM50632584

[2H]C([2H])([2H])NC(=O)c1nnc2Nc3cccc(COCCc4cc(Nc1c2)c(OC)c(c4)-c1ccn(C)n1)n3

BDBM50632585

CNC(=O)c1cnc2Nc3ccc(C)c(COCCc4cc(Nc1c2)c(OC)c(c4)-c1ccn(C)n1)n3

BDBM50632588

CC(=O)Nc1cc(Nc2cccc(n2)S(C)(=O)=O)c(cn1)-c1ccccn1

BDBM50632589

CC(=O)Nc1cc(Nc2cccc(c2)S(C)(=O)=O)c(cn1)-c1ccccn1

BDBM50632590

CC(=O)Nc1cc(Nc2ncccc2S(C)(=O)=O)c(cn1)-c1ccccn1

BDBM50632591

CC(=O)Nc1cc(Nc2ccccc2S(C)(=O)=O)c(cn1)-c1ccccn1

BDBM50632592

COCCOc1cc(Nc2cc(NC(C)=O)ncc2-c2ccccn2)nc(c1)S(C)(=O)=O

BDBM50632593

COc1cc(Nc2cc(NC(C)=O)ncc2-c2ccc(F)cn2)nc(c1)S(C)(=O)=O

BDBM50632594

COc1cc(Nc2cc(NC(C)=O)ncc2-c2ccc(cn2)C(C)(C)O)nc(c1)S(C)(=O)=O

BDBM50632595

COc1cc(Nc2cc(NC(C)=O)ncc2-c2ccc3OC(C)(C)COc3n2)nc(c1)S(C)(=O)=O

BDBM576242

CO[C@]1(CCOC1)c1cc(C)cc(n1)-n1nc(-c2cnn(C)c2)c2cnc(NC(N)=O)cc12 |r|

BDBM50632596

CO[C@]1(CCOC1)c1cc(C)cc(n1)-c1cc(C)n2cnc(NC(N)=O)cc12 |r|

BDBM50632597

CO[C@]1(CCOC1)c1cc(C)cc(n1)-n1cc(C2CC2)c2cnc(NC(C)=O)cc12 |r|

BDBM50632598

CO[C@]1(CCOC1)c1cc(C)cc(n1)-n1cc(C2CCN(C)CC2)c2cnc(NC(N)=O)cc12 |r|

BDBM50632923

Cc1cnc(Nc2ccc(OCCCCCCC(=O)NO)cc2)nc1Nc1cccc(c1)S(=O)(=O)NC(C)(C)C

BDBM50632924

Cc1cnc(Nc2ccc(OCCCCCCC(=O)NO)c(F)c2)nc1Nc1cccc(c1)S(=O)(=O)NC(C)(C)C

BDBM50633569

[H][C@@]1(CC[C@@]2([H])[C@]3([H])C[C@H](OS([O-])(=O)=O)[C@@]4([H])C[C@H](OS([O-])(=O)=O)[C@H](C[C@]4(C)[C@@]3([H])CC[C@]12C)OS([O-])(=O)=O)[C@H](C)C\C=C(/C)C(C)(C)C(C)C |r|

BDBM50636023

N#Cc1ccc(CN2CCC(Nc3c(-c4cn[nH]c4)cnc4[nH]ccc34)CC2)cc1

BDBM50636024

N#Cc1cccc(CN2CCC(Nc3c(-c4cn[nH]c4)cnc4[nH]ccc34)CC2)c1

BDBM50636025

N#Cc1ccccc1CN1CCC(Nc2c(-c3cn[nH]c3)cnc3[nH]ccc23)CC1

BDBM50636026

Clc1ccc(CN2CCC(Nc3c(-c4cn[nH]c4)cnc4[nH]ccc34)CC2)cc1

BDBM50636027

Clc1cccc(CN2CCC(Nc3c(-c4cn[nH]c4)cnc4[nH]ccc34)CC2)c1

BDBM50636028

Clc1ccccc1CN1CCC(Nc2c(-c3cn[nH]c3)cnc3[nH]ccc23)CC1

BDBM50636029

COc1cccc(CN2CCC(Nc3c(-c4cn[nH]c4)cnc4[nH]ccc34)CC2)c1

BDBM50636030

N#Cc1ccc(CN2CCC(Nc3c(-c4cc[nH]n4)cnc4[nH]ccc34)CC2)cc1

BDBM50636031

N#Cc1cccc(CN2CCC(Nc3c(-c4cc[nH]n4)cnc4[nH]ccc34)CC2)c1

BDBM50636032

N#Cc1ccccc1CN1CCC(Nc2c(-c3cc[nH]n3)cnc3[nH]ccc23)CC1

BDBM50636033

Clc1ccc(CN2CCC(Nc3c(-c4cc[nH]n4)cnc4[nH]ccc34)CC2)cc1

BDBM50636034

Clc1cccc(CN2CCC(Nc3c(-c4cc[nH]n4)cnc4[nH]ccc34)CC2)c1

BDBM50636035

Clc1ccccc1CN1CCC(Nc2c(-c3cc[nH]n3)cnc3[nH]ccc23)CC1

BDBM50636036

COc1cccc(CN2CCC(Nc3c(-c4cc[nH]n4)cnc4[nH]ccc34)CC2)c1

BDBM50636037

N#Cc1ccc(CN2CCC(Nc3c(-c4cc[nH]c4)cnc4[nH]ccc34)CC2)cc1

BDBM50636038

N#Cc1cccc(CN2CCC(Nc3c(-c4cc[nH]c4)cnc4[nH]ccc34)CC2)c1

BDBM50636039

N#Cc1ccccc1CN1CCC(Nc2c(-c3cc[nH]c3)cnc3[nH]ccc23)CC1

BDBM50636040

Clc1ccc(CN2CCC(Nc3c(-c4cc[nH]c4)cnc4[nH]ccc34)CC2)cc1

BDBM50636041

Clc1cccc(CN2CCC(Nc3c(-c4cc[nH]c4)cnc4[nH]ccc34)CC2)c1

BDBM50636042

Clc1ccccc1CN1CCC(Nc2c(-c3cc[nH]c3)cnc3[nH]ccc23)CC1

BDBM50636043

COc1cccc(CN2CCC(Nc3c(-c4cc[nH]c4)cnc4[nH]ccc34)CC2)c1

BDBM50636881

CCc1cc(C#N)cc(F)c1N(C)c1cc(NC(=O)C2CC2)c2ncn(C)c2n1

BDBM50636882

CCc1cc(C#N)cc(F)c1N(C)c1cc(NC(=O)NC)c2ncn(C)c2n1

BDBM50636883

CCc1cc(C#N)cc(F)c1N(C)c1cc(Nc2cc(N)ncn2)c2ncn(C)c2n1

BDBM50636884

Cn1cnc2c(Nc3cc(N)ncn3)cc(N(C)[C@H]3CC[C@H](C#N)CC3)nc21

BDBM50636885

CN(c1cc(Nc2cc(N)ncn2)c2ncn(C)c2n1)C1CCOC2(CCC2)C1

BDBM50636886

CN(c1cc(Nc2cc(N)ncn2)c2ncn(C)c2n1)C(C1CC1)C(F)(F)F

BDBM50636887

Cn1cnc2c(Nc3cc(N)ncn3)cc(NC(C3CC3)C(F)(F)F)nc21

BDBM50636888

Cn1cnc2c(Nc3cc(N)ncn3)cc(OC(C3CC3)C(F)(F)F)nc21

BDBM50636889

CCc1cc(C#N)ncc1N(C)c1cc(Nc2cc(N)ncn2)c2ncn(C)c2n1

BDBM50636890

Cc1cc(C#N)ncc1N(C)c1cc(Nc2cc(N)ncn2)c2ncn(C)c2n1

BDBM50636891

Cc1cc(C#N)ncc1Nc1cc(Nc2cc(N)ncn2)c2ncn(C)c2n1

BDBM50636892

Cc1cc(C#N)ncc1Oc1cc(Nc2cc(N)ncn2)c2ncn(C)c2n1

BDBM50636893

Cc1cc(S(C)(=O)=O)nc(F)c1Oc1cc(Nc2cc(N)ncn2)c2ncn(C)c2n1

BDBM50636894

Cc1cc(C#N)ncc1Oc1cc(Nc2ccc(C(=O)N(C)C)cc2)c2ncn(C)c2n1

BDBM50636895

Cc1cc(C#N)ncc1Oc1cc(Nc2ccc(C(=O)N(C)C)cn2)c2ncn(C)c2n1

BDBM50636896

Cc1cc(C#N)ncc1Oc1cc(Nc2ccc(C(=O)N3CCOCC3)cn2)c2ncn(C)c2n1

BDBM50636897

Cc1cc(C#N)ncc1Oc1cc(Nc2ccc(C(=O)N3CCN(C)CC3)cn2)c2ncn(C)c2n1

BDBM50636898

Cc1cc(C#N)ncc1Oc1cc(Nc2ccc(C(=O)N3C[C@@H]4CCN(C)[C@@H]4C3)cn2)c2ncn(C)c2n1

BDBM50636899

Cc1cc(C#N)ncc1Oc1cc(Nc2ccc(N3CCOCC3)cn2)c2ncn(C)c2n1

BDBM50636900

Cc1cc(C#N)ncc1Oc1cc(Nc2ccc(N3CCOCC3)nn2)c2ncn(C)c2n1

BDBM50636901

Cc1cc(C#N)ncc1Oc1cc(Nc2ccc(N3CCN(C)CC3)nn2)c2ncn(C)c2n1

BDBM50636902

Cc1cc(C#N)ncc1Oc1cc(Nc2ccc(N3C[C@@H](C)N(C)[C@@H](C)C3)nn2)c2ncn(C)c2n1

BDBM50636903

CCc1cc(C#N)cc(F)c1N(C)c1nc(NC(=O)C2CC2)c2ncn(C)c2n1

BDBM50652793

Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12

BDBM50652792

Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2c1cnn2C

BDBM50075102

Cc1cn(CCN2CCN(CC2)c2ccccc2-c2cc(cc(c2)C(=O)NCCCN2CCCC2)C#N)c2ccccc12

BDBM185674

CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc4ncccc4c3)C(C)(C)C)c(F)c2)ccn1

BDBM50349102

CCc1cccc(CC)c1NC(=O)c1nn(C)c-2c1CCc1cnc(Nc3ccc(cc3OC(F)(F)F)C(=O)NC3CCN(C)CC3)nc-21

BDBM16018

O=C1c2ccccc2-c2n[nH]c3cccc1c23

BDBM50583996

CN1c2ccsc2C(=O)N(c3c1nc(nc3)Nc4ccc(cc4)S(=O)(=O)N)C

BDBM130909

C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)NC)OC