4097 SMILES Strings for RAC-alpha serine/threonine-protein kinase

Compound Name
SMILES String
N[C@]1(C[C@](O)(C1)C1CC1)c1ccc(cc1)-c1nc2ccc3nnc(C4NCNN4)n3c2cc1-c1ccccc1 |r,wU:3.3,wD:3.6,1.0,(13.13,-7.57,;11.8,-6.8,;12.89,-5.71,;11.8,-4.62,;11.03,-3.29,;10.71,-5.71,;12.57,-3.29,;13.9,-2.52,;12.57,-1.75,;10.46,-7.57,;10.46,-9.11,;9.13,-9.88,;7.8,-9.11,;7.8,-7.57,;9.13,-6.8,;6.46,-9.88,;5.13,-9.11,;3.8,-9.88,;2.46,-9.11,;1.13,-9.88,;1.13,-11.42,;-.02,-12.45,;.61,-13.86,;2.14,-13.7,;3.23,-14.79,;4.76,-14.63,;5.39,-16.03,;4.24,-17.06,;2.91,-16.29,;2.46,-12.19,;3.8,-11.42,;5.13,-12.19,;6.46,-11.42,;7.8,-12.19,;7.8,-13.73,;9.13,-14.5,;10.46,-13.73,;10.46,-12.19,;9.13,-11.42,)|
N[C@]1(C[C@](O)(C1)C1CC1)c1ccc(cc1)-c1nc2ccc3nnc(C(F)F)n3c2cc1-c1ccccc1 |r,wU:3.6,1.0,wD:3.3,(13.13,-7.57,;11.8,-6.8,;10.71,-5.71,;11.8,-4.62,;12.57,-3.29,;12.89,-5.71,;11.03,-3.29,;9.69,-2.52,;11.03,-1.75,;10.46,-7.57,;10.46,-9.11,;9.13,-9.88,;7.8,-9.11,;7.8,-7.57,;9.13,-6.8,;6.46,-9.88,;5.13,-9.11,;3.8,-9.88,;2.46,-9.11,;1.13,-9.88,;1.13,-11.42,;-.02,-12.45,;.61,-13.86,;2.14,-13.7,;3.23,-14.79,;2.83,-16.27,;4.72,-14.39,;2.46,-12.19,;3.8,-11.42,;5.13,-12.19,;6.46,-11.42,;7.8,-12.19,;7.8,-13.73,;9.13,-14.5,;10.46,-13.73,;10.46,-12.19,;9.13,-11.42,)|
CN(C)c1ccc(O)c(c1)C(=O)c1ccc(cc1)C(=O)N[C@@H]1CCCNC[C@H]1NC(=O)c1ccncc1 |r|
CC1(C)CCCNC1c1ccc(O)c(C(=O)c2ccc(cc2)C(=O)N[C@@H]2CCCNC[C@H]2NC(=O)c2ccncc2)c1F |r|
Oc1ccc(cc1C(=O)c1ccc(cc1)C(=O)N[C@@H]1CCCNC[C@H]1NC(=O)c1ccncc1)N1CCCCC1 |r|
CC1(C)CCCN(C1)c1ccc(O)c(c1)C(=O)c1ccc(cc1)C(=O)N[C@@H]1CCCNC[C@H]1NC(=O)c1ccncc1 |r|
CC1(C)CCN(CC1)c1ccc(O)c(c1)C(=O)c1ccc(cc1)C(=O)N[C@@H]1CCCNC[C@H]1NC(=O)c1ccncc1 |r|
COc1ccc(O)c(C(=O)c2ccc(cc2)C(=O)O[C@@H]2CCCNC[C@H]2NC(=O)c2ccncc2)c1F |r|
COc1ccc(O)c(C(=O)c2ccc(cc2)C(=O)N[C@@H]2CCCNC[C@H]2NC(=O)c2ccncc2)c1F |r|
COc1ccc(O)c(C(=O)c2ccc(CO[C@@H]3CCCNC[C@H]3NC(=O)c3ccncc3)cc2)c1F |r|
COc1ccc(O)c(C(=O)c2ccc(NC[C@@H]3CCCNC[C@H]3NC(=O)c3ccncc3)cc2)c1F |r|
COc1ccc(O)c(C(=O)c2ccc(CN[C@@H]3CCCNC[C@H]3NC(=O)c3ccncc3)cc2)c1F |r|
COc1ccc(O)c(C(=O)c2ccc(\C=C\[C@@H]3CCCNC[C@H]3NC(=O)c3ccncc3)cc2)c1F |r|
CC(C)(N)c1ccc(cc1)-c1nc2ccccc2nc1-c1ccccc1
O=c1[nH]c2ccccc2n1C1CCN(Cc2ccc(cc2)-c2nc3ccccc3nc2-c2ccccc2)CC1
O=c1[nH]c2ccccc2n1C1CCN(Cc2ccc(cc2)-c2ncc(=O)[nH]c2-c2ccccc2)CC1
O=c1[nH]c2ccccc2n1C1CCN(Cc2ccc(cc2)-c2[nH]c(=O)cnc2-c2ccccc2)CC1
Cc1nc(-c2ccc(CN3CCC(CC3)n3c4ccccc4[nH]c3=O)cc2)c([nH]c1=O)-c1ccccc1
Cc1nc(-c2ccccc2)c([nH]c1=O)-c1ccc(CN2CCC(CC2)n2c3ccccc3[nH]c2=O)cc1
O=c1[nH]c2ccccc2n1C1CCN(Cc2ccc(cc2)-c2nc(Cc3ccccc3)c(=O)[nH]c2-c2ccccc2)CC1
O=c1[nH]c2ccccc2n1C1CCN(Cc2ccc(cc2)-c2[nH]c(=O)c(Cc3ccccc3)nc2-c2ccccc2)CC1
Oc1ccc(Cc2nc(-c3ccc(CN4CCC(CC4)n4c5ccccc5[nH]c4=O)cc3)c([nH]c2=O)-c2ccccc2)cc1
Oc1ccc(Cc2nc(-c3ccccc3)c([nH]c2=O)-c2ccc(CN3CCC(CC3)n3c4ccccc4[nH]c3=O)cc2)cc1
CCC(C)c1nc(-c2ccc(CN3CCC(CC3)n3c4ccccc4[nH]c3=O)cc2)c([nH]c1=O)-c1ccccc1
CCC(C)c1nc(-c2ccccc2)c([nH]c1=O)-c1ccc(CN2CCC(CC2)n2c3ccccc3[nH]c2=O)cc1
CC(C)Cc1nc(-c2ccc(CN3CCC(CC3)n3c4ccccc4[nH]c3=O)cc2)c([nH]c1=O)-c1ccccc1
CC(C)Cc1nc(-c2ccccc2)c([nH]c1=O)-c1ccc(CN2CCC(CC2)n2c3ccccc3[nH]c2=O)cc1
OC(=O)c1ccc2nc(-c3ccc(CN4CCC(CC4)n4c5ccccc5[nH]c4=O)cc3)c(nc2c1)-c1ccccc1
OC(=O)c1ccc2nc(-c3ccccc3)c(nc2c1)-c1ccc(CN2CCC(CC2)n2c3ccccc3[nH]c2=O)cc1
O=c1[nH]c2ccccc2n1C1CCN(Cc2ccc(cc2)-c2nc3ccc(cc3nc2-c2ccccc2)-c2nnn[nH]2)CC1
O=c1[nH]c2ccccc2n1C1CCN(Cc2ccc(cc2)-c2nc3cc(ccc3nc2-c2ccccc2)-c2nnn[nH]2)CC1
Cn1nnc(n1)-c1ccc2nc(-c3ccc(CN4CCC(CC4)n4c5ccccc5[nH]c4=O)cc3)c(nc2c1)-c1ccccc1
Cn1nnc(n1)-c1ccc2nc(-c3ccccc3)c(nc2c1)-c1ccc(CN2CCC(CC2)n2c3ccccc3[nH]c2=O)cc1
O=c1[nH]c2ccccc2n1C1CCN(Cc2ccc(cc2)-c2nc3cc4cn[nH]c4cc3nc2-c2ccccc2)CC1
O=c1[nH]c2ccccc2n1C1CCN(Cc2ccc(cc2)-c2nc3cc4[nH]cnc4cc3nc2-c2ccccc2)CC1
O=c1[nH]c2ccccc2n1C1CCN(Cc2ccc(cc2)-c2nc3ccccc3cc2-c2ccccc2)CC1
O=c1[nH]c2ccccc2n1C1CCN(Cc2ccc(cc2)-c2cc3ccccc3nc2-c2ccccc2)CC1
O=c1[nH]c2ccccc2n1C1CCN(Cc2ccc(cc2)-c2ncc(cc2-c2ccccc2)C#N)CC1
N#Cc1cnc(-c2ccc(CNCc3ccc(cc3)-c3csnn3)cc2)c(c1)-c1ccccc1
Fc1ccc2nc([nH]c2c1)C1CCN(Cc2ccc(cc2)-c2ncc(cc2-c2ccccc2)C#N)CC1
Cc1ccc2nc([nH]c2c1)C1CCN(Cc2ccc(cc2)-c2ncc(cc2-c2ccccc2)C#N)CC1
N#Cc1cnc(-c2ccc(CN3CCC(CC3)c3nc4ccccc4[nH]3)cc2)c(c1)-c1ccccc1
N#Cc1cnc(-c2ccc(CN3CCC(CC3)n3cnc4ccccc34)cc2)c(c1)-c1ccccc1
Cc1nc2ccccc2n1C1CCN(Cc2ccc(cc2)-c2ncc(cc2-c2ccccc2)C#N)CC1
O=c1[nH]c2ccccc2n1C1CCN(Cc2ccc(cc2)-c2ncc(cc2-c2ccccc2)-c2nnn[nH]2)CC1
C(NCc1ccc(cc1)-c1ncc(cc1-c1ccccc1)-c1nnn[nH]1)c1ccc(cc1)-c1csnn1
Fc1ccc2nc([nH]c2c1)C1CCN(Cc2ccc(cc2)-c2ncc(cc2-c2ccccc2)-c2nnn[nH]2)CC1
Cc1ccc2nc([nH]c2c1)C1CCN(Cc2ccc(cc2)-c2ncc(cc2-c2ccccc2)-c2nnn[nH]2)CC1
C(N1CCC(CC1)c1nc2ccccc2[nH]1)c1ccc(cc1)-c1ncc(cc1-c1ccccc1)-c1nnn[nH]1
C(N1CCC(CC1)n1cnc2ccccc12)c1ccc(cc1)-c1ncc(cc1-c1ccccc1)-c1nnn[nH]1
Cc1nc2ccccc2n1C1CCN(Cc2ccc(cc2)-c2ncc(cc2-c2ccccc2)-c2nnn[nH]2)CC1
Cc1c(C#N)c(N)[nH]c2c(C#N)c(=C)c(=Cc3ccc(o3)-c3ccc(C(O)=O)c(Cl)c3)c12 |w:15.15|
Clc1ccc2[nH]c(=O)c(C(=O)\C=C\c3nc4ccccc4[nH]3)c(-c3ccccc3)c2c1
[#8]-[#6](=O)-c1cc(ccc1-[#8])-c1ccc(\[#6]=[#6]-2/[#6](=O)-c3ccccc3-[#6]-2=O)o1
Cc1c(C#N)c(N)[nH]c2c(C#N)c(=C)c(=Cc3ccc(o3)-c3ccc(cc3)C(O)=O)c12 |w:15.15|
Cc1c(C#N)c(N)[nH]c2c(C#N)c(=C)c(=Cc3ccc(o3)-c3cccc(c3)C(O)=O)c12 |w:15.15|
COc1cc(ccc1O)-c1ccc2c(n[nH]c2c1)-c1nc2ccccc2[nH]1
c1ccc2[nH]c(nc2c1)-c1n[nH]c2ccccc12
NC1=NC(=O)C(N1)=C1CCNC(=O)c2[nH]ccc12 |w:7.18,t:1|
N(c1ccccc1-c1nnc[nH]1)c1ncnc2[nH]ccc12
Cn1ccc2c(Nc3ccccc3-c3nnc[nH]3)ncnc12
Cc1c[nH]c2ncnc(Nc3ccccc3-c3nnc[nH]3)c12
Clc1c[nH]c2ncnc(Nc3ccccc3-c3nnc[nH]3)c12
Cc1nnc([nH]1)-c1ccccc1Nc1ncnc2[nH]ccc12
Cc1nnc([nH]1)-c1cc(Cl)ccc1Nc1ncnc2[nH]ccc12
Cc1nnc([nH]1)-c1ccc(Cl)cc1Nc1ncnc2[nH]ccc12
C1Cc2nc[nH]c2CN1c1ncnc2[nH]ccc12
Clc1c[nH]c2ncnc(N3CCc4nc[nH]c4C3)c12
C1N(c2ccccc2C11CCNCC1)c1ncnc2[nH]ccc12
Clc1ccc2N(CC3(CCNCC3)c2c1)c1ncnc2[nH]ccc12
Fc1ccc2N(CC3(CCNCC3)c2c1)c1ncnc2[nH]ccc12
CN1CCC2(CN(c3ccccc23)c2ncnc3[nH]ccc23)CC1
CC(=O)N1CCC2(CN(c3ccc(F)cc23)c2ncnc3[nH]ccc23)CC1
CS(=O)(=O)N1CCC2(CN(c3ccc(F)cc23)c2ncnc3[nH]ccc23)CC1
Clc1c[nH]c2ncnc(N3CC4(CCNCC4)c4ccccc34)c12
Cc1c[nH]c2ncnc(N3CC4(CCNCC4)c4ccccc34)c12
C(c1c[nH]c2ncnc(N3CC4(CCNCC4)c4ccccc34)c12)c1ccccc1
N#Cc1c[nH]c2ncnc(N3CC4(CCNCC4)c4ccccc34)c12
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CNCCC(N)=O)cc1
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CNCCCN2CCN(C)CC2)cc1
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CNCCc2cnc[nH]2)cc1
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CNCCc2nnc[nH]2)cc1
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CNCCc2nccs2)cc1
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CNCCc2cccnc2)cc1
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CNCCCn2ccnc2)cc1
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN(C)CCc2cn[nH]c2)cc1
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CNCCc2nnc(C)[nH]2)cc1
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CNCCc2nnc([nH]2)-c2ccccc2)cc1
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CNCCc2nnc(N)s2)cc1
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CNCCC(=O)c2ccccc2N)cc1
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)C(N)=O)cc1
CCNC(=O)NC1CCN(Cc2ccc(cc2)-c2nc3nc(SC)ncc3cc2-c2ccccc2)CC1
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)C(=O)NCCC(N)=O)cc1
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)NC(=O)CNC(C)=O)cc1
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc(N)s2)cc1
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)C(=O)Nc2ccncc2)cc1
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nc(no2)-c2cccnc2)cc1
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2cc(n[nH]2)-c2ccncc2)cc1
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
COc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
N#Cc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
NC(=O)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
CNc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Nc1ncnc2nc(-c3ccc(CN4CCC(CC4)c4nc5ccc(F)cc5[nH]4)cc3)c(cc12)-c1ccccc1
Nc1ncnc2n(ncc12)C1CCN(Cc2ccc(cc2)-c2nc3ncnc(N)c3cc2-c2ccccc2)CC1
CSc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)n2ncc3c(N)ncnc23)cc1
Nc1ncnc2n(cnc12)C1CCN(Cc2ccc(cc2)-c2ncc(cc2-c2ccccc2)-c2nnn[nH]2)CC1
Nc1nnc(s1)-c1cnc(-c2ccc(CN3CCC(CC3)c3cc(n[nH]3)-c3ccncc3)cc2)c(c1)-c1ccccc1
Nc1nnc(s1)-c1cnc(-c2ccc(CN3CCC(CC3)c3cc(n[nH]3)-c3ccccn3)cc2)c(c1)-c1ccccc1
Nc1nnc(s1)-c1cnc(-c2ccc(CN3CCC(CC3)c3nnc([nH]3)-c3ccccn3)cc2)c(c1)-c1ccccc1
Nc1nnc(s1)-c1cnc(-c2ccc(CN3CCC(CC3)n3cc(cn3)-c3ccccn3)cc2)c(c1)-c1ccccc1
Nc1nnc(s1)-c1cnc(-c2ccc(CN3CCC(CC3)n3cc(cn3)-c3cnccn3)cc2)c(c1)-c1ccccc1
Nc1nnc(s1)-c1cnc(-c2ccc(CN3CCC(CC3)n3ncc4c(N)ncnc34)cc2)c(c1)-c1ccccc1
Nc1nnc(s1)-c1cnc(-c2ccc(CN3CCC(CC3)n3c4cccnc4[nH]c3=O)cc2)c(c1)-c1ccccc1
Nc1nnc(s1)-c1cnc(-c2ccc(CNCCC(=O)c3ccccc3N)cc2)c(c1)-c1ccccc1
Nc1ncnc2n(ncc12)C1CCN(Cc2ccc(cc2)-c2ncc(cc2-c2ccccc2)-c2ccccn2)CC1
Nc1ncnc2n(ncc12)C1CCN(Cc2ccc(cc2)-c2ncc(cc2-c2ccccc2)-c2nccs2)CC1
Nc1ncnc2n(ncc12)C1CCN(Cc2ccc(cc2)-c2ncc(cc2-c2ccccc2)-c2ncccn2)CC1
Nc1ncnc2n(ncc12)C1CCN(Cc2ccc(cc2)-c2ncc(cc2-c2ccccc2)-c2ncon2)CC1
Nc1ncnc2n(ncc12)C1CCN(Cc2ccc(cc2)-c2ncc(cc2-c2ccccc2)-c2nnc[nH]2)CC1
CCn1c(nc2cncc(OC3CCNCC3)c12)-c1nonc1N
CCn1c(nc2cncc(C(=O)NCCNC)c12)-c1nonc1N
CCn1c(nc2cncc(C(=O)N3CC[C@@H](N)C3)c12)-c1nonc1N |r|
CCn1c(nc2cncc(C(=O)N3CCNCC3)c12)-c1nonc1N
CCn1c(nc2cncc(C(=O)NC3CCCNC3)c12)-c1nonc1N
CCn1c(nc2cncc(OCC3CCNCC3)c12)-c1nonc1N
CCn1c(nc2cncc(C(=O)NC3CCNCC3)c12)-c1nonc1N
CCn1c(nc2cncc(CNC3CCNCC3)c12)-c1nonc1N
CCn1c(nc2c(ncc(OCCCN)c12)-c1ccccc1)-c1nonc1N
CCn1c(nc2c(ncc(OCCCN)c12)-c1ccc[nH]1)-c1nonc1N
CCn1c(nc2c(ncc(OCCCN)c12)-c1ccoc1)-c1nonc1N
CCn1c(nc2c(ncc(OCCCN)c12)-c1cc[nH]c1)-c1nonc1N
CCn1c(nc2c(ncc(OCCCN)c12)-c1cn[nH]c1)-c1nonc1N
CCn1c(nc2c(ncc(OCCCN)c12)C#CC1CC1)-c1nonc1N
CCn1c(nc2c(ncc(OCCCN)c12)C#CC(C)(C)O)-c1nonc1N
CCn1c(nc2c(ncc(OCCCN)c12)C#CCO)-c1nonc1N
CCn1c(nc2c(ncc(OCCCN)c12)C#CCCO)-c1nonc1N
CCn1c(nc2c(ncc(OCCCN)c12)C#CCN)-c1nonc1N
CCn1c(nc2c(ncc(OCCCCN)c12)C#CC(C)(C)O)-c1nonc1N
CCn1c(nc2c(ncc(OCC3CCNCC3)c12)C#CC(C)(C)O)-c1nonc1N
CCn1c(nc2c(ncc(OCCN)c12)C#CC(C)(C)O)-c1nonc1N
CCn1c(nc2c(ncc(OCC[C@@H](N)Cc3ccccc3)c12)C#CC(C)(C)O)-c1nonc1N |r|
CCn1c(nc2c(ncc(OCC3CCNC3)c12)C#CC(C)(C)O)-c1nonc1N
CCn1c(nc2c(ncc(OC3CCNCC3)c12)C#CC(C)(C)O)-c1nonc1N
CCn1c(nc2c(ncc(OC[C@H]3CCCNC3)c12)C#CC(C)(C)O)-c1nonc1N |r|
CCn1c(nc2c(ncc(OC[C@@H]3CCCNC3)c12)C#CC(C)(C)O)-c1nonc1N |r|
CCn1c(nc2c(ncc(OCCCNCCc3ccc(OC)cc3)c12)C#CC(C)(C)O)-c1nonc1N
CCn1c(nc2c(ncc(OCCCNC[C@H](O)CO)c12)C#CC(C)(C)O)-c1nonc1N |r|
O=C(Nc1nc(cs1)-c1ccncc1)C1COc2ccccc2O1
O=C(Nc1ccc(cc1)-c1ccncc1)C1COc2ccccc2O1
O=C(Nc1ccc(cc1)-c1cn[nH]c1)C1COc2ccccc2O1
COc1cc(ccc1NC(=O)C1COc2ccccc2O1)-c1cn[nH]c1
CN(C)CCOc1cc(ccc1NC(=O)C1COc2ccccc2O1)-c1cn[nH]c1
C[C@H]1OC(C[C@H]([C@@H]1O)N(C)C)c1ccc2C(=O)C3=C([C@@H](C)O[C@@H]4CC(=O)O[C@H]34)C(=O)c2c1O |r,t:18|
C[C@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1c(O)cccc1C2=O |r,c:10|
CCC[C@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1c(O)cccc1C2=O |r,c:12|
CCC[C@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1c(OC)cccc1C2=O |r,c:12|
CCC[C@H]1O[C@H](CC(O)=O)CC2=C1C(=O)c1c(O)cccc1C2=O |r,c:11|
O=C1C[C@H]2OCC3=C([C@H]2O1)C(=O)c1ccccc1C3=O |r,c:6|
O=C1C[C@H]2O[C@H](c3cccs3)C3=C([C@H]2O1)C(=O)c1ccccc1C3=O |r,c:12|
O=C1C[C@H]2O[C@H](COCc3ccccc3)C3=C([C@H]2O1)C(=O)c1ccccc1C3=O |r,c:16|
Oc1ccc(cc1)[C@@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1ccccc1C2=O |r,c:17|
O=C1C[C@@H]2O[C@H](c3ccsc3)C3=C([C@@H]2O1)C(=O)c1ccccc1C3=O |r,c:12|
O=C1C[C@H]2O[C@@H](c3ccsc3)C3=C([C@H]2O1)C(=O)c1ccccc1C3=O |r,c:12|
C[C@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1ccccc1C2=O |r,c:10|
CCC[C@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1ccccc1C2=O |r,c:12|
O=C1C[C@H]2O[C@]3(CCCC3)C3=C([C@H]2O1)C(=O)c1ccccc1C3=O |r,c:11|
Oc1cccc(c1)[C@@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1ccccc1C2=O |r,c:17|
CCC[C@@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1ccccc1C2=O |r,c:12|
Nc1ccc(cc1)[C@@H]1O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1ccccc1C2=O |r,c:17|
CC1(C)O[C@@H]2CC(=O)O[C@@H]2C2=C1C(=O)c1ccccc1C2=O |r,c:11|
[#6]-[#6](-[#6])-[#6](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6]-2-[#6]-[#6]-[#6]-[#7]-2-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)cc1)-[#6](=O)-[#7]-[#6](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1
[#6]-[#6](-[#6])-[#6](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6]-2-[#6]-[#6]-[#6]-[#7]-2-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)c(-[#6])c1)-[#6](=O)-[#7]-[#6](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1
[#6]-[#6](-[#6])-[#6](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6]-2-[#6]-[#6]-[#6]-[#7]-2-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)c(c1)-c1ccccc1)-[#6](=O)-[#7]-[#6](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1
[#6]-[#6](-[#6])-[#6](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6]-2-[#6]-[#6]-[#6]-[#7]-2-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)cc1-c1ccccc1)-[#6](=O)-[#7]-[#6](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1
[#6]-[#6](-[#6])-[#6](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6]-2-[#6]-[#6]-[#6]-[#7]-2-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)cc1-c1cccc2ccccc12)-[#6](=O)-[#7]-[#6](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1
[#6]-[#6](-[#6])-[#6](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](-[#6])=O)c(c1)-c1ccccc1)-[#6](=O)-[#7]-[#6](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1
[#6]-[#6](-[#6])-[#6](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](-[#6])=O)cc1-c1ccccc1)-[#6](=O)-[#7]-[#6](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1
[#6]-[#6](-[#6])-[#6](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](-[#6])=O)cc1)-[#6](=O)-[#7]-[#6](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1
NC(=N)NCCNc1ccc(cc1)C(=O)Nc1ccc(cc1)N(Cc1ccccc1)Cc1ccccc1
NC(=N)NCCNc1ccc(cc1-c1ccccc1)C(=O)Nc1ccc(cc1)N(Cc1ccccc1)Cc1ccccc1
Cc1ccc(CN(Cc2ccc(C)cc2)c2ccc(NC(=O)c3ccc(NCCNC(N)=N)c(c3)-c3ccccc3)cc2)cc1
Cc1cccc(CN(Cc2cccc(C)c2)c2ccc(NC(=O)c3ccc(NCCNC(N)=N)c(c3)-c3ccccc3)cc2)c1
NC(=N)NCCNc1ccc(cc1-c1ccccc1)C(=O)Nc1ccc(cc1)N(Cc1ccc(cc1)-c1ccccc1)Cc1ccc(cc1)-c1ccccc1
NC(=N)NCCNc1ccc(cc1-c1ccccc1)C(=O)Nc1ccc(cc1)N(Cc1ccc(F)cc1)Cc1ccc(F)cc1
NC(=N)NCCNc1ccc(cc1-c1ccccc1)C(=O)Nc1ccc(cc1)N(Cc1cccc2ccccc12)Cc1cccc2ccccc12
CC(C)c1ccc(CN(Cc2ccc(cc2)C(C)C)c2ccc(NC(=O)c3ccc(NCCNC(N)=N)c(c3)-c3ccccc3)cc2)cc1
NC(=N)NCCNc1ccc(cc1-c1ccccc1)C(=O)Nc1ccc(cc1)N(Cc1ccc2ccccc2c1)Cc1ccc2ccccc2c1
NC(=N)NCCNc1ccc(cc1-c1ccccc1)C(=O)Nc1ccc(cc1)N(Cc1ccc(cc1)C#N)Cc1ccc(cc1)C#N
CC(C)c1ccc(CN(Cc2ccc(cc2)C(C)C)c2ccc(NC(=O)c3ccc(NCCNC(N)=N)c(c3)-c3ccc4ccccc4c3)cc2)cc1
NC(=N)NCCNc1ccc(cc1-c1ccc2ccccc2c1)C(=O)Nc1ccc(cc1)N(Cc1ccc(cc1)C#N)Cc1ccc(cc1)C#N
CC(=O)Nc1ccc(cc1)-c1cc(ccc1NCCNC(N)=N)C(=O)Nc1ccc(cc1)N(Cc1ccccc1)Cc1ccccc1
COC(=O)c1ccc(cc1)-c1cc(ccc1NCCNC(N)=N)C(=O)Nc1ccc(cc1)N(Cc1ccccc1)Cc1ccccc1
NC(=N)NCCNc1ccc(cc1-c1ccc(cc1)-c1ccccc1)C(=O)Nc1ccc(cc1)N(Cc1ccccc1)Cc1ccccc1
NC(=N)NCCNc1ccc(cc1-c1ccc(cc1)C#N)C(=O)Nc1ccc(cc1)N(Cc1ccccc1)Cc1ccccc1
CC(C)c1ccc(cc1)-c1cc(ccc1NCCNC(N)=N)C(=O)Nc1ccc(cc1)N(Cc1ccccc1)Cc1ccccc1
NC(=N)NCCNc1ccc(cc1-c1ccc2ccccc2c1)C(=O)Nc1ccc(cc1)N(Cc1ccccc1)Cc1ccccc1
[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-c1ccc(cc1)-[#6](=O)-[#7]-c1ccc2c(c1)n(-[#6]-c1ccccc1)c(=O)n(-[#6]-c1ccccc1)c2=O |r|
[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-c1ccc(cc1)-[#6](=O)-[#7]-c1ccc2n(-[#6]-c3ccccc3)c(=O)n(-[#6]-c3ccccc3)c(=O)c2c1 |r|
CC(C)c1ccc(CN(Cc2ccc(cc2)C(C)C)c2ccc(NC(=O)c3ccc(NC(=O)CNC(N)=N)c(c3)-c3ccc4ccccc4c3)cc2)cc1
NC(=N)NCC(=O)Nc1ccc(cc1-c1ccc2ccccc2c1)C(=O)Nc1ccc(cc1)N(Cc1ccc(cc1)C#N)Cc1ccc(cc1)C#N
NC(N)=NCC(=O)Nc1ccc(cc1)-c1cc2cc(ccc2[nH]1)N(Cc1ccccc1)Cc1ccccc1 |(-17.82,3.92,;-17.05,2.59,;-17.82,1.26,;-15.51,2.59,;-14.74,3.92,;-13.2,3.92,;-12.43,2.59,;-12.43,5.25,;-10.89,5.25,;-10.12,6.59,;-8.58,6.58,;-7.81,5.25,;-8.58,3.92,;-10.12,3.92,;-6.27,5.25,;-5.36,6.5,;-3.9,6.02,;-2.57,6.79,;-1.23,6.02,;-1.23,4.48,;-2.57,3.71,;-3.9,4.48,;-5.36,4,;.1,6.79,;1.43,6.02,;1.43,4.48,;.1,3.71,;.1,2.17,;1.43,1.4,;2.77,2.17,;2.77,3.71,;.1,8.33,;1.43,9.1,;1.43,10.64,;2.77,11.41,;4.1,10.64,;4.1,9.1,;2.77,8.33,)|
NC(N)=NCC(=O)Nc1ccc(cc1)-c1cc2cc(ccc2[nH]1)N(Cc1ccc(cc1)C#N)Cc1ccc(cc1)C#N |(-17.82,3.92,;-17.05,2.59,;-17.82,1.26,;-15.51,2.59,;-14.74,3.92,;-13.2,3.92,;-12.43,2.59,;-12.43,5.25,;-10.89,5.25,;-10.12,6.59,;-8.58,6.58,;-7.81,5.25,;-8.58,3.92,;-10.12,3.92,;-6.27,5.25,;-5.36,6.5,;-3.9,6.02,;-2.57,6.79,;-1.23,6.02,;-1.23,4.48,;-2.57,3.71,;-3.9,4.48,;-5.36,4,;.1,6.79,;1.43,6.02,;1.43,4.48,;.1,3.71,;.1,2.17,;1.43,1.4,;2.77,2.17,;2.77,3.71,;1.43,-.14,;1.43,-1.68,;.1,8.33,;1.43,9.1,;1.43,10.64,;2.77,11.41,;4.1,10.64,;4.1,9.1,;2.77,8.33,;5.44,11.41,;6.77,12.18,)|
[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|
CN[C@H]1C[C@@H]2O[C@](C)([C@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13
[O-][N+](=O)c1ccc(Nc2c3ccccc3nc3ccccc23)cc1
Brc1ccc(cc1)C(=O)NNC1=Nc2cccc3cccc1c23 |t:12|
[H]C12CCC([H])(C1)C(C2C(O)=O)C(=O)Nc1sc2CCCCCc2c1C(=O)OC |TLB:12:7:6:3.2,THB:9:8:6:3.2|
CSc1ccccc1C(=O)NCc1ccc(F)cc1
CC1Cc2ccccc2N1c1ncnc(N)c1[N+]([O-])=O
Cc1cc(NC(=O)CCC(=O)N(Cc2ccco2)C(C(=O)NCC2CCCO2)c2ccncc2)no1
O=C(Nc1ccccc1C(=O)N1CCCC1)C1COc2ccccc2O1
O=C(CSc1ccc2nnc(-c3cccnc3)n2n1)c1ccccc1
CCOC(=O)c1sc(=NC(=O)CCS(=O)(=O)c2ccccc2)n(C)c1C |w:8.8|
Clc1ccc(Cl)c(c1)N1CSCC1=O
OC(=O)c1cc(c[nH]1)C(=O)C1CCCCC1
COc1ccc(Cn2c(=O)[nH]c3cc(ccc3c2=O)C(=O)NC2CCCC2)cc1
Cc1c(C#N)c(N)nc(Cl)c1C#N
COc1ccc(CNC(=O)C2Cc3ccccc3CN2C(=O)c2ccco2)cc1
Cn1cccc1C(=O)NC(=O)COC(=O)c1cc(ccc1Cl)S(=O)(=O)N1CCCCC1
O=C(CSc1ccncc1)Nc1ccc2ccccc2c1
CC(N=Nc1ncc(Cl)cc1Cl)c1ccccn1 |w:3.3|
CCCc1cc(=O)[nH]c(SCCCCN2C(=O)c3ccccc3C2=O)n1
Cc1[nH]nc2c1c(=O)n(CCCN)c1ccc(Br)cc21
CC(C)(C)c1nc2c([nH]1)c1ccc(F)cc1c1c2cc[nH]c1=O
CCNC(=O)O[C@@H]1CC[C@@H]2[C@H](C[C@H]1N2Cc1ccccc1)C(=O)Nc1ccc(cc1)N(C)C |r,THB:14:13:10.11:6.8.7|
CCCCCNC(=O)O[C@@H]1CC[C@@H]2[C@H](C[C@H]1N2CCC(C)C)C(=O)Nc1ccc(cc1)N(C)C |r,THB:17:16:13.14:9.11.10|
Oc1ccc2oc3c(CCCNC3=O)c2c1
Oc1ccc2oc(=O)c3NCCCc3c2c1
NC(=O)n1c2cc(-c3ccccc3)c(nc2ccc1=N)-c1ccc(cc1)C1(CCC1)NC(=O)Cc1cccnc1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(=N)n(C(=N)c3ccccc3)c2cc1-c1ccccc1
NC(=N)n1c2cc(-c3ccccc3)c(nc2ccc1=N)-c1ccc(cc1)C1(N)CCC1
CC(=N)n1c2cc(-c3ccccc3)c(nc2ccc1=N)-c1ccc(cc1)C1(N)CCC1
NC1(CC(F)(F)C1)c1ccc(cc1)-c1nc2ccc(=N)n(C(=N)c3ccccc3)c2cc1-c1ccccc1
C[C@@]1(O)C[C@@](N)(C1)c1ccc(cc1)-c1nc2ccc3nnc(C(F)F)n3c2cc1-c1ccccc1 |r,wU:1.0,4.4,wD:1.1,(11.03,-3.29,;11.8,-4.62,;12.57,-3.29,;12.89,-5.71,;11.8,-6.8,;13.13,-7.57,;10.71,-5.71,;10.46,-7.57,;10.46,-9.11,;9.13,-9.88,;7.8,-9.11,;7.8,-7.57,;9.13,-6.8,;6.46,-9.88,;5.13,-9.11,;3.8,-9.88,;2.46,-9.11,;1.13,-9.88,;1.13,-11.42,;-.02,-12.45,;.61,-13.86,;2.14,-13.7,;3.23,-14.79,;2.83,-16.27,;4.72,-14.39,;2.46,-12.19,;3.8,-11.42,;5.13,-12.19,;6.46,-11.42,;7.8,-12.19,;7.8,-13.73,;9.13,-14.5,;10.46,-13.73,;10.46,-12.19,;9.13,-11.42,)|
N1c2ccccc2-c2nnc(-c3ccccc3)n2-c2cccnc12
N1c2ccccc2-c2nnc(-c3ccco3)n2-c2cccnc12
Nc1cc(ccn1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
N1c2ccccc2-c2nnc(-c3ccc[nH]3)n2-c2cccnc12
Nc1ccc(cn1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Cc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CC(C)(C)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
FC(F)(F)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Clc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
N1c2ccccc2-c2nnc(-c3ccc4ccccc4c3)n2-c2cccnc12
Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CN(C)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Clc1ccc(cc1Cl)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CN1c2ccccc2-c2nnc(-c3ccc4ccccc4c3)n2-c2ccccc12
Fc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Fc1cccc(F)c1-c1nnc2-c3ccccc3Nc3ncccc3-n12 |(-.17,4.6,;-1.5,3.83,;-2.83,4.6,;-4.17,3.83,;-4.17,2.29,;-2.83,1.52,;-3.6,.19,;-1.5,2.29,;-.17,1.52,;1.3,2,;2.2,.75,;1.3,-.49,;1.84,-1.94,;3.38,-1.94,;4.17,-3.26,;3.38,-4.6,;1.84,-4.6,;1.05,-3.26,;-.48,-3.46,;-1.45,-2.41,;-2.79,-3.18,;-4.12,-2.41,;-4.12,-.87,;-2.79,-.1,;-1.45,-.87,;-.17,-.02,)|
Fc1ccc(-c2nnc3-c4ccccc4Nc4ncccc4-n23)c(F)c1
Nc1cccc(c1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Oc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
N1c2ccccc2-c2nnc(-c3ccccc3)n2-c2ccccc12
CN(C)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ccccc3-n12
Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ccccc3-n12
OCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=c1[nH]c2ccccc2n1C1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
COC(=O)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=C(N1CCC(CC1)n1c2ccccc2[nH]c1=O)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
COc1cccc(c1)C(=O)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=C(Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1ccc2ccccc2c1
FC(F)(F)c1cc(cc(c1)C(F)(F)F)C(=O)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Cc1ccc(cc1)C(=O)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
COc1ccc(cc1)C(=O)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CCCC(=O)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CC(C)CC(=O)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=C(Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1cccc2ccccc12
O=C(Cc1cccc2ccccc12)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CC(C)(C)CC(=O)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Fc1ccc(cc1F)C(=O)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=C(Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1ccc(cc1)[N+]#[C-]
CCC(=O)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=C(Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1cccnc1
COc1ccccc1C(=O)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=C(Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1cc2ccccc2s1
CC(C)(C)C(=O)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CC(C)(C)c1ccc(cc1)C(=O)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CN(C)c1ccc(cc1)C(=O)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Fc1ccc(cc1C(F)(F)F)C(=O)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=C(Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1ccc2OCOc2c1
Cc1cc(no1)C(=O)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=C(Cc1ccccc1)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=C(Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1ccco1
Fc1ccccc1C(=O)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
FC(F)(F)c1ccc(cc1)C(=O)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
COCC(=O)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=C(CCc1ccccc1)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=C(Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1cnc2ccccc2n1
Fc1ccc(cc1)C(=O)Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=C(Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)C1CCC1
O=C(Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1ccncc1
O=C(Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1ccccc1
O=C(Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1cccc(c1)[N+]#[C-]
O=C(Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1ccc(cc1)-c1ccccc1
NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CS(=O)(=O)OCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
C(N1CCCC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
C(NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1ccccc1
Fc1ccccc1N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
CC(C)CCNCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
C(NC1CCC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CCN(Cc1ccncc1)Cc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CC(C)CNCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CN(C)C(=O)CN1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
COCCNCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
C(N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1)c1ccncc1
CN(CCc1ccccn1)Cc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
OCC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
COCCN(C)Cc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=C1CCCN1CCCNCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CN(CCc1ccccc1)Cc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
OC1(CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1)c1ccccc1
CCN(CC)C(=O)C1CCCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)C1
C(N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1)c1ccccc1
OC1CCCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)C1
C(N1CCOCC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CC(C)CN(C)Cc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CC(=O)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)C1
CCCNCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CN(Cc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)C1CCN(C)CC1
CCOC(=O)N1CCC(CC1)NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CCCN(C)Cc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Cc1ccc(CN2CCN(Cc3ccc(cc3)-c3nnc4-c5ccccc5Nc5ncccc5-n34)CC2)cc1
O=C(N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1)c1ccco1
C(NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)C1CC1
C(Cc1ccccc1)N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
Fc1ccc(cc1)C(=O)NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=C(NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1cccnc1
O=C(NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1ccco1
CN(C)c1ccc(cc1)C(=O)NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=C(NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1ccccc1
O=C(NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)C1CCC1
O=S(=O)(NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1ccccc1
COc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Cn1cnc(c1)S(=O)(=O)NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Cn1ccc(n1)S(=O)(=O)NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=S(=O)(NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1cccnc1
O=S(=O)(Nc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1ccccc1
O=C(NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)Nc1ccccc1
O=S(=O)(NCCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1ccccc1
COc1ccc(cc1)S(=O)(=O)NCCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=C(NCCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)Nc1ccccc1
O=C(NCCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1ccccc1
Fc1ccccc1S(=O)(=O)NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Fc1cccc(c1)S(=O)(=O)NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
COc1cccc(c1)S(=O)(=O)NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Cc1cccc(c1)S(=O)(=O)NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Clc1cccc(c1)S(=O)(=O)NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Fc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Cc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Clc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CC(=O)Nc1ccc(cc1)S(=O)(=O)NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Fc1ccccc1NC(=O)NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Fc1cccc(NC(=O)NCc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)c1
COc1cccc(NC(=O)NCc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)c1
Fc1ccc(NC(=O)NCc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)cc1
Cc1cccc(NC(=O)NCc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)c1
NC1(CCC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
ClCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=c1[nH]c2ccccc2n1C1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ccccc4-n23)CC1
C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ccccc3-n12
O=C(NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1)c1ccc(cc1)[N+]#[C-]
C(N1CCC(CC1)c1nnc([nH]1)-c1ccncc1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Fc1ccc(cc1)C(=O)N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
O=C(C1CCCC1)N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
COc1ccccc1C(=O)N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
O=C(CCc1ccccc1)N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
Cc1cccc(c1)C(=O)N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
COc1ccc(cc1)C(=O)N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
COc1cccc(c1)C(=O)N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
O=C(N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1)c1ccc(cc1)[N+]#[C-]
O=C(Cc1ccccc1)N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
Fc1ccccc1C(=O)N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
Cc1cc(no1)C(=O)N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
Fc1ccc(cc1F)C(=O)N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
O=C(N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1)c1ccccc1
COC(=O)c1sccc1S(=O)(=O)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
Cc1noc(C)c1S(=O)(=O)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
Fc1ccccc1S(=O)(=O)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
O=S(=O)(CC1CCCCC1)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
O=S(=O)(NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1)C1CC1
COc1cccc(c1)S(=O)(=O)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
CC(=O)Nc1ccc(cc1)S(=O)(=O)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
O=S(=O)(Cc1ccccc1)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
Cc1nc(C)c(s1)S(=O)(=O)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
CC(C)CS(=O)(=O)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
CC(=O)c1ccc(cc1)S(=O)(=O)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
O=S(=O)(NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1)c1ccc2OCCOc2c1
Fc1cccc(c1)S(=O)(=O)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
O=C(N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1)c1ccc2OCOc2c1
O=C(N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1)c1cccc(c1)[N+]#[C-]
Cc1ccc(cc1)C(=O)N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
O=C(N1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1)c1ccccn1
O=C1NCN(c2ccccc2)C11CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
[C-]#[N+]C1(CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1)c1ccccc1
Fc1ccc(cc1)C(=O)C1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
Fc1ccc(NC(=O)NC2CCN(Cc3ccc(cc3)-c3nnc4-c5ccccc5Nc5ncccc5-n34)CC2)cc1
COc1ccc(C)cc1NC(=O)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
Fc1ccccc1NC(=O)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
Cc1ccc(NC(=O)NC2CCN(Cc3ccc(cc3)-c3nnc4-c5ccccc5Nc5ncccc5-n34)CC2)cc1
COc1ccc(CCNC(=O)NC2CCN(Cc3ccc(cc3)-c3nnc4-c5ccccc5Nc5ncccc5-n34)CC2)cc1OC
Cc1cccc(NC(=O)NC2CCN(Cc3ccc(cc3)-c3nnc4-c5ccccc5Nc5ncccc5-n34)CC2)c1
COc1cccc(CNC(=O)NC2CCN(Cc3ccc(cc3)-c3nnc4-c5ccccc5Nc5ncccc5-n34)CC2)c1
COc1ccc(NC(=O)NC2CCN(Cc3ccc(cc3)-c3nnc4-c5ccccc5Nc5ncccc5-n34)CC2)cc1Cl
Clc1ccccc1CNC(=O)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
FC(F)(F)c1cccc(NC(=O)NC2CCN(Cc3ccc(cc3)-c3nnc4-c5ccccc5Nc5ncccc5-n34)CC2)c1
O=C(NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1)Nc1ccc2OCCc2c1
Clc1cccc(NC(=O)NC2CCN(Cc3ccc(cc3)-c3nnc4-c5ccccc5Nc5ncccc5-n34)CC2)c1
CCCc1ccccc1NC(=O)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
Fc1cccc(NC(=O)NC2CCN(Cc3ccc(cc3)-c3nnc4-c5ccccc5Nc5ncccc5-n34)CC2)c1
Cc1ccccc1NC(=O)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
Clc1ccc(CCNC(=O)NC2CCN(Cc3ccc(cc3)-c3nnc4-c5ccccc5Nc5ncccc5-n34)CC2)cc1
Cc1ccccc1CNC(=O)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
O=C(NCCc1cccs1)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
COc1ccccc1NC(=O)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
COc1ccc(NC(=O)NC2CCN(Cc3ccc(cc3)-c3nnc4-c5ccccc5Nc5ncccc5-n34)CC2)c(C)c1
Cc1cc(COCc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)no1
C(OCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1cn(nn1)-c1ccccc1
C(N1CCC(CC1)c1c[nH]c2ccccc12)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
C(N1CCC(CC1)Oc1ccccc1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
C(N1CCCC(C1)Oc1ccccc1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Cc1noc(n1)C1CCCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)C1
O=c1[nH]c(cn1C1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1)-c1ccccc1
CC(C)(N)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=C(NC1(CCC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1ccccc1
O=C(Nc1ccccc1)NC1(CCC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=S(=O)(NC1(CCC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12)c1ccccc1
C1CNC(C1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Fc1ccc(cc1)S(=O)(=O)NC1(CCC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Cc1ccc(cc1)S(=O)(=O)NC1(CCC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Cc1cccc(c1)S(=O)(=O)NC1(CCC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Fc1ccc(cc1)C(=O)NC1(CCC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CC(C)(C)OC(=O)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
Fc1ccc2c(CCNCc3ccc(cc3)-c3nnc4-c5ccccc5Nc5ncccc5-n34)c[nH]c2c1
Clc1ccc2nc(CCNCc3ccc(cc3)-c3nnc4-c5ccccc5Nc5ncccc5-n34)[nH]c2c1
Fc1cccc(c1)S(=O)(=O)NC1(CCC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Cn1ccc(n1)S(=O)(=O)NC1(CCC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Cc1cc(no1)C(=O)NC1(CCC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
C(N1CCC(CC1)c1nnc(o1)-c1ccccc1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Cc1ccc2Nc3ncccc3-n3c(nnc3-c2c1)-c1ccc(cc1)C1(N)CCC1
NC1(CCCCC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Cc1cccc2-c3nnc(-c4ccc(cc4)C4(N)CCC4)n3-c3cccnc3Nc12
NC1(CCC1)c1ccc(cc1)-c1nnc2-c3cc(Br)ccc3Nc3ncccc3-n12
NC1(CCC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ccncc3-n12
CC(C)(C)OC(=O)NC1(CC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
NC1(CC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
Cc1ccc2-c3nnc(-c4ccc(cc4)C4(N)CCC4)n3-c3cccnc3Nc2c1
NC1(CCC1)c1ccc(cc1)-c1nnc2-c3cc(ccc3Nc3ncccc3-n12)-c1ccccc1
OCc1ccc(cc1)-c1nnc2-c3cc(Br)ccc3Nc3ncccc3-n12
FC(F)(F)C(=O)NC1(CCC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3nc(Cl)ccc3-n12
NCc1ccc(cc1)-c1nnc2-c3cc(Br)ccc3Nc3ncccc3-n12
Brc1ccc2Nc3ncccc3-n3c(nnc3-c2c1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
C(Cc1ccccc1)NC1(CCC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
NC1(CCC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncc(cc3-n12)-c1ccccc1
CC(C)(C)OC(=O)N1CCN(CC1)C(=O)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
O=C(N1CCNCC1)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CC(C)(C)OC(=O)NC1CCN(CC1)C(=O)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
NC1CCN(CC1)C(=O)c1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CC(C)(C)OC(=O)NCCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
CC(C)(C)OC(=O)NCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
NCCc1ccc(cc1)-c1nnc2-c3ccccc3Nc3ncccc3-n12
COc1cccc(c1)C(=O)NC1CCN(Cc2ccc(cc2)-c2nnc3-c4ccccc4Nc4ncccc4-n23)CC1
CC(C)(C)C(=O)Nc1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(cc3)C3(N)CCC3)c2n1
CC(=O)OC(C)(C)C(=O)Nc1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(cc3)C3(N)CCC3)c2n1
CC(C)(O)C(=O)Nc1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(cc3)C3(N)CCC3)c2n1
C[C@H](O)CNC(=O)c1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(cc3)C3(N)CCC3)c2n1 |r|
C[C@@H](O)CNC(=O)c1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(cc3)C3(N)CCC3)c2n1 |r|
CN(C)C(=O)C1CCN(CC1)c1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(cc3)C3(N)CCC3)c2n1
CCN(CC)C(=O)C1CCN(CC1)c1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(cc3)C3(N)CCC3)c2n1
Nc1ncccc1-c1nc2ccc(nc2n1-c1ccc(cc1)C1(N)CCC1)-c1cccc(c1)N1CCC(CC1)C(=O)N1CCOCC1
CC(=O)NC1CCN(CC1)c1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(cc3)C3(N)CCC3)c2n1
CCC(=O)N1CCN(CC1)c1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(cc3)C3(N)CCC3)c2n1
Nc1ncccc1-c1nc2ccc(nc2n1-c1ccc(cc1)C1(N)CCC1)-c1cccc(c1)N1CCN(CC1)C(=O)C1CC1
CC(C)C(=O)N1CCN(CC1)c1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(cc3)C3(N)CCC3)c2n1
CC(C)(C)C(=O)N1CCN(CC1)c1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(cc3)C3(N)CCC3)c2n1
C[C@H]1CN(C[C@@H](C)O1)c1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(cc3)C3(N)CCC3)c2n1 |r|
Nc1ncccc1-c1nc2ccc(nc2n1-c1ccc(cc1)C1(N)CCC1)-c1cccc(c1)N1CCS(=O)(=O)CC1
Nc1ncccc1-c1nc2ccc(Nc3ccc(cc3)N3CCOCC3)nc2n1-c1ccc(cc1)C1(N)CCC1
Nc1ncccc1-c1nc2ccc(Sc3ccccc3)nc2n1-c1ccc(cc1)C1(N)CCC1
Nc1ncccc1-c1nc2ccc(Oc3ccccc3)nc2n1-c1ccc(cc1)C1(N)CCC1
Nc1ncccc1-c1nc2ccc(nc2n1-c1ccc(cc1)C1(N)CCC1)-c1cccc(NC(=O)C2CC2)c1
Nc1ncccc1-c1nc2ccc(Nc3ccccc3)nc2n1-c1ccc(cc1)C1(N)CCC1
Oc1c(Cl)cc(cc1NC(=S)NC(=O)c1ccccc1)[N+]([O-])=O
Cc1cc(C)cc(c1)C(=O)NC(=S)Nc1cc(ccc1O)[N+]([O-])=O
Cc1cc(C)cc(c1)C(=O)NC(=S)Nc1c(O)cc(C)c(Cl)c1C
Cc1cc(C)cc(c1)C(=O)NC(=S)Nc1cc(ccc1O)C(F)(F)F
Cc1cc(C)cc(c1)C(=O)NC(=S)Nc1c(O)cc(cc1C(F)(F)F)C(F)(F)F
Cc1cc(C)cc(c1)C(=O)NC(=S)Nc1c(O)cc(C)c(Br)c1C
Cc1cc(C)cc(c1)C(=O)NC(=S)Nc1cc(ccc1O)-c1ccccc1
NC1(CC(O)(C1)C1CC1)c1ccc(cc1)-c1nc2-c3c(F)cccc3OCn2c1-c1ccccc1 |(7.56,3.47,;6.23,4.24,;5.14,5.33,;6.31,6.43,;6.36,7.97,;7.32,5.33,;4.9,7.07,;3.57,6.3,;4.13,8.4,;4.89,3.47,;3.56,4.24,;2.23,3.47,;2.23,1.93,;3.56,1.16,;4.89,1.93,;.93,1.09,;-.5,1.64,;-1.47,.45,;-3.01,.45,;-3.78,1.78,;-2.69,2.87,;-5.32,1.78,;-6.09,.45,;-5.32,-.89,;-3.78,-.89,;-3.01,-2.22,;-1.47,-2.22,;-.7,-.89,;.85,-.45,;2.06,-1.41,;1.66,-2.89,;2.75,-3.98,;4.23,-3.58,;4.63,-2.1,;3.54,-1.01,)|
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3c(F)cccc3OCn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2-c3c(F)cccc3OCn2c1-c1ccccc1
NC1(CC(O)(C1)C1CC1)c1ccc(cc1)-c1nc2-c3c(F)cccc3OCn2c1-c1ccsc1 |(7.56,3.47,;6.23,4.24,;5.14,5.33,;6.31,6.43,;6.36,7.97,;7.32,5.33,;4.9,7.07,;3.57,6.3,;4.13,8.4,;4.89,3.47,;3.56,4.24,;2.23,3.47,;2.23,1.93,;3.56,1.16,;4.89,1.93,;.93,1.09,;-.5,1.64,;-1.47,.45,;-3.01,.45,;-3.78,1.78,;-2.69,2.87,;-5.32,1.78,;-6.09,.45,;-5.32,-.89,;-3.78,-.89,;-3.01,-2.22,;-1.47,-2.22,;-.7,-.89,;.85,-.45,;2.06,-1.41,;3.49,-.85,;4.46,-2.05,;3.62,-3.34,;2.14,-2.94,)|
NC1(CC(O)(C1)C1CC1)c1ccc(cc1)-c1nc2-c3c(F)cccc3OCn2c1-c1ccncc1 |(7.56,3.47,;6.23,4.24,;5.14,5.33,;6.31,6.43,;6.36,7.97,;7.32,5.33,;4.9,7.07,;3.57,6.3,;4.13,8.4,;4.89,3.47,;3.56,4.24,;2.23,3.47,;2.23,1.93,;3.56,1.16,;4.89,1.93,;.93,1.09,;-.5,1.64,;-1.47,.45,;-3.01,.45,;-3.78,1.78,;-2.69,2.87,;-5.32,1.78,;-6.09,.45,;-5.32,-.89,;-3.78,-.89,;-3.01,-2.22,;-1.47,-2.22,;-.7,-.89,;.85,-.45,;2.06,-1.41,;1.66,-2.89,;2.75,-3.98,;4.23,-3.58,;4.63,-2.1,;3.54,-1.01,)|
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3c(F)cccc3OCn2c1-c1ccsc1
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3c(F)cccc3OCn2c1-c1ccncc1
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3cc(F)ccc3OCn2c1-c1ccccc1
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3ccc(F)cc3OCn2c1-c1ccccc1
NC1(CC(O)(C1)C1CC1)c1ccc(cc1)-c1nc2-c3cccc(F)c3OCn2c1-c1ccccc1 |(7.56,3.47,;6.23,4.24,;5.14,5.33,;6.31,6.43,;6.36,7.97,;7.32,5.33,;4.9,7.07,;3.42,6.67,;4.51,8.55,;4.89,3.47,;3.56,4.24,;2.23,3.47,;2.23,1.93,;3.56,1.16,;4.89,1.93,;.93,1.09,;-.5,1.64,;-1.47,.45,;-3.01,.45,;-3.78,1.78,;-5.32,1.78,;-6.09,.45,;-5.32,-.89,;-6.09,-2.22,;-3.78,-.89,;-3.01,-2.22,;-1.47,-2.22,;-.7,-.89,;.85,-.45,;2.06,-1.41,;1.66,-2.89,;2.75,-3.98,;4.23,-3.58,;4.63,-2.1,;3.54,-1.01,)|
NC1(CC(O)(C1)C1CC1)c1ccc(cc1)-c1nc2-c3ccccc3OCn2c1-c1ccccc1 |(7.56,3.47,;6.23,4.24,;5.14,5.33,;6.31,6.43,;6.36,7.97,;7.32,5.33,;4.9,7.07,;3.42,6.67,;4.51,8.55,;4.89,3.47,;3.56,4.24,;2.23,3.47,;2.23,1.93,;3.56,1.16,;4.89,1.93,;.93,1.09,;-.5,1.64,;-1.47,.45,;-3.01,.45,;-3.78,1.78,;-5.32,1.78,;-6.09,.45,;-5.32,-.89,;-3.78,-.89,;-3.01,-2.22,;-1.47,-2.22,;-.7,-.89,;.85,-.45,;2.06,-1.41,;1.66,-2.89,;2.75,-3.98,;4.23,-3.58,;4.63,-2.1,;3.54,-1.01,)|
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3ccccc3OCn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2-c3ccccc3OCn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2-c3ccccc3OCn2c1-c1ccsc1
NC1(CCC1)c1ccc(cc1)-c1nc2-c3ccccc3OCn2c1-c1ccncc1
COc1cccc2OCn3c(nc(c3-c3ccccc3)-c3ccc(cc3)C3(N)CC(O)(C3)C3CC3)-c12 |(-3.09,4.36,;-2.69,2.87,;-3.78,1.78,;-5.32,1.78,;-6.09,.45,;-5.32,-.89,;-3.78,-.89,;-3.01,-2.22,;-1.47,-2.22,;-.7,-.89,;-1.47,.45,;-.5,1.64,;.93,1.09,;.85,-.45,;2.06,-1.41,;1.66,-2.89,;2.75,-3.98,;4.23,-3.58,;4.63,-2.1,;3.54,-1.01,;2.23,1.93,;2.23,3.47,;3.56,4.24,;4.89,3.47,;4.89,1.93,;3.56,1.16,;6.23,4.24,;7.56,3.47,;5.14,5.33,;6.31,6.43,;6.36,7.97,;7.32,5.33,;4.9,7.07,;3.57,6.3,;4.13,8.4,;-3.01,.45,)|
COc1ccc2OCn3c(nc(c3-c3ccccc3)-c3ccc(cc3)C3(N)CC(O)(C3)C3CC3)-c2c1 |(-5.32,4.45,;-6.09,3.11,;-5.32,1.78,;-6.09,.45,;-5.32,-.89,;-3.78,-.89,;-3.01,-2.22,;-1.47,-2.22,;-.7,-.89,;-1.47,.45,;-.5,1.64,;.93,1.09,;.85,-.45,;2.06,-1.41,;1.66,-2.89,;2.75,-3.98,;4.23,-3.58,;4.63,-2.1,;3.54,-1.01,;2.23,1.93,;2.23,3.47,;3.56,4.24,;4.89,3.47,;4.89,1.93,;3.56,1.16,;6.23,4.24,;7.56,3.47,;5.14,5.33,;6.31,6.43,;6.36,7.97,;7.32,5.33,;4.9,7.07,;3.57,6.3,;4.13,8.4,;-3.01,.45,;-3.78,1.78,)|
COc1ccc2-c3nc(c(-c4ccccc4)n3COc2c1)-c1ccc(cc1)C1(N)CC(O)(C1)C1CC1 |(-8.4,-.89,;-7.63,.45,;-6.09,.45,;-5.32,1.78,;-3.78,1.78,;-3.01,.45,;-1.47,.45,;-.5,1.64,;.93,1.09,;.85,-.45,;2.06,-1.41,;1.66,-2.89,;2.75,-3.98,;4.23,-3.58,;4.63,-2.1,;3.54,-1.01,;-.7,-.89,;-1.47,-2.22,;-3.01,-2.22,;-3.78,-.89,;-5.32,-.89,;2.23,1.93,;2.23,3.47,;3.56,4.24,;4.89,3.47,;4.89,1.93,;3.56,1.16,;6.23,4.24,;7.56,3.47,;5.14,5.33,;6.31,6.43,;6.36,7.97,;7.32,5.33,;4.9,7.07,;3.57,6.3,;4.13,8.4,)|
COc1cccc2OCn3c(nc(c3-c3ccccc3)-c3ccc(cc3)C3(N)CC(O)(C3)C3CC3)-c12 |(-3.78,4.45,;-3.01,3.11,;-3.78,1.78,;-5.32,1.78,;-6.09,.45,;-5.32,-.89,;-3.78,-.89,;-3.01,-2.22,;-1.47,-2.22,;-.7,-.89,;-1.47,.45,;-.5,1.64,;.93,1.09,;.85,-.45,;2.06,-1.41,;1.66,-2.89,;2.75,-3.98,;4.23,-3.58,;4.63,-2.1,;3.54,-1.01,;2.23,1.93,;2.23,3.47,;3.56,4.24,;4.89,3.47,;4.89,1.93,;3.56,1.16,;6.23,4.24,;7.56,3.47,;5.14,5.33,;6.31,6.43,;6.36,7.97,;7.32,5.33,;4.9,7.07,;3.57,6.3,;4.13,8.4,;-3.01,.45,)|
COc1ccc2OCn3c(nc(c3-c3ccccc3)-c3ccc(cc3)C3(N)CC(C)(O)C3)-c2c1
COc1ccc2-c3nc(c(-c4ccccc4)n3COc2c1)-c1ccc(cc1)C1(N)CC(C)(O)C1
NC1(CC(O)(C1)C1CC1)c1ccc(cc1)-c1nc2-c3c(Cl)cccc3OCn2c1-c1ccccc1 |(7.56,3.47,;6.23,4.24,;5.14,5.33,;6.31,6.43,;6.36,7.97,;7.32,5.33,;4.9,7.07,;3.57,6.3,;4.13,8.4,;4.89,3.47,;3.56,4.24,;2.23,3.47,;2.23,1.93,;3.56,1.16,;4.89,1.93,;.93,1.09,;-.5,1.64,;-1.47,.45,;-3.01,.45,;-3.78,1.78,;-2.69,2.87,;-5.32,1.78,;-6.09,.45,;-5.32,-.89,;-3.78,-.89,;-3.01,-2.22,;-1.47,-2.22,;-.7,-.89,;.85,-.45,;2.06,-1.41,;1.66,-2.89,;2.75,-3.98,;4.23,-3.58,;4.63,-2.1,;3.54,-1.01,)|
CCOc1cccc2OCn3c(nc(c3-c3ccccc3)-c3ccc(cc3)C3(N)CC(O)(C3)C3CC3)-c12 |(-2,5.45,;-3.09,4.36,;-2.69,2.87,;-3.78,1.78,;-5.32,1.78,;-6.09,.45,;-5.32,-.89,;-3.78,-.89,;-3.01,-2.22,;-1.47,-2.22,;-.7,-.89,;-1.47,.45,;-.5,1.64,;.93,1.09,;.85,-.45,;2.06,-1.41,;1.66,-2.89,;2.75,-3.98,;4.23,-3.58,;4.63,-2.1,;3.54,-1.01,;2.23,1.93,;2.23,3.47,;3.56,4.24,;4.89,3.47,;4.89,1.93,;3.56,1.16,;6.23,4.24,;7.56,3.47,;5.14,5.33,;6.31,6.43,;6.36,7.97,;7.32,5.33,;4.9,7.07,;3.57,6.3,;4.13,8.4,;-3.01,.45,)|
CCOc1cccc2OCn3c(nc(c3-c3ccccc3)-c3ccc(cc3)C3(N)CC(C)(O)C3)-c12
COc1cc(OC)c2-c3nc(c(-c4ccccc4)n3COc2c1)-c1ccc(cc1)C1(N)CC(O)(C1)C1CC1 |(-8.4,-.89,;-7.63,.45,;-6.09,.45,;-5.32,1.78,;-3.78,1.78,;-2.69,2.87,;-3.09,4.36,;-3.01,.45,;-1.47,.45,;-.5,1.64,;.93,1.09,;.85,-.45,;2.06,-1.41,;1.66,-2.89,;2.75,-3.98,;4.23,-3.58,;4.63,-2.1,;3.54,-1.01,;-.7,-.89,;-1.47,-2.22,;-3.01,-2.22,;-3.78,-.89,;-5.32,-.89,;2.23,1.93,;2.23,3.47,;3.56,4.24,;4.89,3.47,;4.89,1.93,;3.56,1.16,;6.23,4.24,;7.56,3.47,;5.14,5.33,;6.31,6.43,;6.36,7.97,;7.32,5.33,;4.9,7.07,;3.57,6.3,;4.13,8.4,)|
Cc1ccc2-c3nc(c(-c4ccccc4)n3COc2c1)-c1ccc(cc1)C1(N)CC(O)(C1)C1CC1 |(-7.63,.45,;-6.09,.45,;-5.32,1.78,;-3.78,1.78,;-3.01,.45,;-1.47,.45,;-.5,1.64,;.93,1.09,;.85,-.45,;2.06,-1.41,;1.66,-2.89,;2.75,-3.98,;4.23,-3.58,;4.63,-2.1,;3.54,-1.01,;-.7,-.89,;-1.47,-2.22,;-3.01,-2.22,;-3.78,-.89,;-5.32,-.89,;2.23,1.93,;2.23,3.47,;3.56,4.24,;4.89,3.47,;4.89,1.93,;3.56,1.16,;6.23,4.24,;7.56,3.47,;5.14,5.33,;6.31,6.43,;6.36,7.97,;7.32,5.33,;4.9,7.07,;3.57,6.3,;4.13,8.4,)|
NC1(CC(O)(C1)C1CC1)c1ccc(cc1)-c1nc2-c3ncccc3OCn2c1-c1ccccc1 |(7.56,3.47,;6.23,4.24,;5.14,5.33,;6.31,6.43,;6.36,7.97,;7.32,5.33,;4.9,7.07,;3.57,6.3,;4.13,8.4,;4.89,3.47,;3.56,4.24,;2.23,3.47,;2.23,1.93,;3.56,1.16,;4.89,1.93,;.93,1.09,;-.5,1.64,;-1.47,.45,;-3.01,.45,;-3.78,1.78,;-5.32,1.78,;-6.09,.45,;-5.32,-.89,;-3.78,-.89,;-3.01,-2.22,;-1.47,-2.22,;-.7,-.89,;.85,-.45,;2.06,-1.41,;1.66,-2.89,;2.75,-3.98,;4.23,-3.58,;4.63,-2.1,;3.54,-1.01,)|
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3ncccc3OCn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2-c3ncccc3OCn2c1-c1ccccc1
CCC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3ncccc3OCn2c1-c1ccccc1
CCC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3cnccc3OCn2c1-c1ccccc1
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3cnccc3OCn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2-c3cnccc3OCn2c1-c1ccccc1
CCC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3cnccc3OCn2c1-c1ccccc1
NC1(CC(O)(C1)C1CC1)c1ccc(cc1)-c1nc2-c3ccncc3OCn2c1-c1ccccc1 |(7.56,3.47,;6.23,4.24,;5.14,5.33,;6.31,6.43,;6.36,7.97,;7.32,5.33,;4.9,7.07,;3.57,6.3,;4.13,8.4,;4.89,3.47,;3.56,4.24,;2.23,3.47,;2.23,1.93,;3.56,1.16,;4.89,1.93,;.93,1.09,;-.5,1.64,;-1.47,.45,;-3.01,.45,;-3.78,1.78,;-5.32,1.78,;-6.09,.45,;-5.32,-.89,;-3.78,-.89,;-3.01,-2.22,;-1.47,-2.22,;-.7,-.89,;.85,-.45,;2.06,-1.41,;1.66,-2.89,;2.75,-3.98,;4.23,-3.58,;4.63,-2.1,;3.54,-1.01,)|
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3ccncc3OCn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2-c3ccncc3OCn2c1-c1ccccc1
NC1(CC(O)(C1)C1CC1)c1ccc(cc1)-c1nc2-c3cccnc3OCn2c1-c1ccccc1 |(7.56,3.47,;6.23,4.24,;5.14,5.33,;6.31,6.43,;6.36,7.97,;7.32,5.33,;4.9,7.07,;3.57,6.3,;4.13,8.4,;4.89,3.47,;3.56,4.24,;2.23,3.47,;2.23,1.93,;3.56,1.16,;4.89,1.93,;.93,1.09,;-.5,1.64,;-1.47,.45,;-3.01,.45,;-3.78,1.78,;-5.32,1.78,;-6.09,.45,;-5.32,-.89,;-3.78,-.89,;-3.01,-2.22,;-1.47,-2.22,;-.7,-.89,;.85,-.45,;2.06,-1.41,;1.66,-2.89,;2.75,-3.98,;4.23,-3.58,;4.63,-2.1,;3.54,-1.01,)|
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3cccnc3OCn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2-c3cccnc3OCn2c1-c1ccccc1
NC1(CC(O)(C1)C1CC1)c1ccc(cc1)-c1nc2-c3nccnc3OCn2c1-c1ccccc1 |(7.56,3.47,;6.23,4.24,;5.14,5.33,;6.31,6.43,;6.36,7.97,;7.32,5.33,;4.9,7.07,;3.57,6.3,;4.13,8.4,;4.89,3.47,;3.56,4.24,;2.23,3.47,;2.23,1.93,;3.56,1.16,;4.89,1.93,;.93,1.09,;-.5,1.64,;-1.47,.45,;-3.01,.45,;-3.78,1.78,;-5.32,1.78,;-6.09,.45,;-5.32,-.89,;-3.78,-.89,;-3.01,-2.22,;-1.47,-2.22,;-.7,-.89,;.85,-.45,;2.06,-1.41,;1.66,-2.89,;2.75,-3.98,;4.23,-3.58,;4.63,-2.1,;3.54,-1.01,)|
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3nccnc3OCn2c1-c1ccccc1
CCC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3nccnc3OCn2c1-c1ccccc1
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3cc(CO)ccc3OCn2c1-c1ccccc1
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3ccc(CO)cc3OCn2c1-c1ccccc1
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3ccc(cc3OCn2c1-c1ccccc1)C#N
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3cc(ccc3OCn2c1-c1ccccc1)C#N
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3cc(ccc3OCn2c1-c1ccccc1)-c1ccn[nH]1
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3cc(ccc3OCn2c1-c1ccccc1)-c1cn[nH]c1
Cc1cnc2-c3nc(c(-c4ccccc4)n3COc2c1)-c1ccc(cc1)C1(N)CC(C)(O)C1
COc1ccc2OCn3c(nc(c3-c3ccccc3)-c3ccc(cc3)C3(N)CC(C)(O)C3)-c2n1
CNC(=O)c1ccc2OCn3c(nc(c3-c3ccccc3)-c3ccc(cc3)C3(N)CC(C)(O)C3)-c2c1
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3cc(ccc3OCn2c1-c1ccccc1)C(N)=O
CN(C)C(=O)c1ccc2OCn3c(nc(c3-c3ccccc3)-c3ccc(cc3)C3(N)CC(C)(O)C3)-c2c1
CCNC(=O)c1ccc2OCn3c(nc(c3-c3ccccc3)-c3ccc(cc3)C3(N)CC(C)(O)C3)-c2c1
CNC(=O)c1ccc2-c3nc(c(-c4ccccc4)n3COc2c1)-c1ccc(cc1)C1(N)CC(C)(O)C1
CN(C)C(=O)c1ccc2-c3nc(c(-c4ccccc4)n3COc2c1)-c1ccc(cc1)C1(N)CC(C)(O)C1
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3ccc(cc3OCn2c1-c1ccccc1)C(=O)NCCO
CCONC(=O)c1ccc2-c3nc(c(-c4ccccc4)n3COc2c1)-c1ccc(cc1)C1(N)CC(C)(O)C1
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3cc(ccc3OCn2c1-c1ccccc1)C(=O)NCCO
CCONC(=O)c1ccc2OCn3c(nc(c3-c3ccccc3)-c3ccc(cc3)C3(N)CC(C)(O)C3)-c2c1
CC1(O)CC(N)(C1)c1ccc(cc1)-c1nc2-c3ccc(cc3OCn2c1-c1ccccc1)C(N)=O
CC1(O)CC(O)(C1)c1ccc(cc1)-c1nc2-c3cc(ccc3OCn2c1-c1ccccc1)C(O)=O
CC1(O)CC(O)(C1)c1ccc(cc1)-c1nc2-c3ccc(cc3OCn2c1-c1ccccc1)C(O)=O
COC(=O)c1ccccc1-c1nc2ccc(nc2n1-c1ccc(cc1)C1(N)CCC1)-c1cccc(c1)N1CCOCC1
Cc1ccccc1-c1nc2ccc(nc2n1-c1ccc(cc1)C1(N)CCC1)-c1cccc(c1)N1CCOCC1
NC1(CCC1)c1ccc(cc1)-n1c(nc2ccc(nc12)-c1cccc(c1)N1CCOCC1)C1CCCCC1
NC1(CCC1)c1ccc(cc1)-n1c(nc2ccc(nc12)-c1cccc(c1)N1CCOCC1)C1CC1
Nc1ncnc(Cl)c1-c1nc2ccc(nc2n1-c1ccc(cc1)C1(N)CCC1)-c1ccccc1 |(6.97,-2.37,;7.74,-3.71,;9.28,-3.71,;10.05,-5.04,;9.28,-6.38,;7.74,-6.38,;6.97,-7.71,;6.97,-5.04,;5.43,-5.04,;4.52,-3.8,;3.06,-4.27,;1.72,-3.5,;.39,-4.27,;.39,-5.81,;1.72,-6.58,;3.06,-5.81,;4.52,-6.29,;4.52,-7.83,;5.86,-8.6,;5.86,-10.14,;4.52,-10.91,;3.19,-10.14,;3.19,-8.6,;4.52,-12.45,;3.19,-13.22,;5.29,-13.78,;6.63,-13.01,;5.86,-11.68,;-.94,-6.58,;-2.28,-5.81,;-3.61,-6.58,;-3.61,-8.12,;-2.28,-8.89,;-.94,-8.12,)|
Cn1cc(c(N)n1)-c1nc2ccc(nc2n1-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
Nc1nccnc1-c1nc2ccc(nc2n1-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-n1c(nc2ccc(nc12)-c1ccccc1)-c1cccnc1
NC1(CCC1)c1ccc(cc1)-n1c(nc2ccc(nc12)-c1ccccc1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-n1c(nc2ccc(nc12)-c1ccccc1)-c1ccccc1O
NC1(CCC1)c1ccc(cc1)-n1c(nc2ccc(nc12)-c1ccccc1)-c1cccnc1F
Nc1ccccc1-c1nc2ccc(nc2n1-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-n1c(nc2ccc(nc12)-c1cccc(c1)N1CCOCC1)-c1ccccn1
NC1(CCC1)c1ccc(cc1)-n1c(nc2ccc(nc12)-c1cccc(c1)N1CCOCC1)-c1cc[nH]n1
NC1(CCC1)c1ccc(cc1)-n1c(nc2ccc(nc12)-c1cccc(c1)N1CCOCC1)-c1cccc(O)c1
COc1ccc(cc1)-c1nc2ccc(nc2n1-c1ccc(cc1)C1(N)CCC1)-c1cccc(c1)N1CCOCC1
NC1(CCC1)c1ccc(cc1)-n1c(nc2ccc(nc12)-c1cccc(c1)N1CCOCC1)-c1cccc(F)c1
NC1(CCC1)c1ccc(cc1)-n1c(nc2ccc(nc12)-c1cccc(c1)N1CCOCC1)-c1cccc(Cl)c1
NC1(CCC1)c1ccc(cc1)-n1c(nc2ccc(nc12)-c1cccc(c1)N1CCOCC1)-c1ccc(Cl)cc1
NC1(CCC1)c1ccc(cc1)-n1c(nc2ccc(nc12)-c1cccc(c1)N1CCOCC1)-c1ncccn1
NC1(CCC1)c1ccc(cc1)-n1c(nc2ccc(nc12)-c1cccc(c1)N1CCOCC1)-c1ccnnc1
CN(C)C(=O)c1cccc(c1)-c1ccc2nc(-c3ccccc3)n(-c3ccc(cc3)C3(N)CCC3)c2n1
NC1(CCC1)c1ccc(cc1)-n1c(nc2ccc(NCc3ccccc3)nc12)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-n1c(nc2ccc(Nc3ccccc3)nc12)-c1ccccc1
Fc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CC1(C)CN(C(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c2ccccc12
C[C@H]1Cc2ccccc2N1C(=O)CC3=NC(=CC(=O)N3)N4CCOCC4
C[C@@H]1Cc2ccccc2N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1 |r|
NC(=O)c1ccc(N2CCN(CC2)c2cccc(c2)C(F)(F)F)c2cncnc12
C(N1CC(C1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nccn2cc1-c1ccccc1
Cc1nc2nc(-c3ccc(CN4CC(C4)c4nnc([nH]4)-c4ccccn4)cc3)c(cn2n1)-c1ccccc1
Fc1cnc2nc(-c3ccc(CN4CC(C4)c4nnc([nH]4)-c4ccccn4)cc3)c(cn12)-c1ccccc1
Clc1cnc2nc(-c3ccc(CN4CC(C4)c4nnc([nH]4)-c4ccccn4)cc3)c(cn12)-c1ccccc1
C(N1CCC(CC1)c1nc2ccncc2[nH]1)c1ccc(cc1)-c1nc2nccn2cc1-c1ccccc1
C(N1CCC(CC1)c1nc2cccnc2[nH]1)c1ccc(cc1)-c1nc2nccn2cc1-c1ccccc1
N#Cc1ccc2nc([nH]c2c1)C1CCN(Cc2ccc(cc2)-c2nc3nccn3cc2-c2ccccc2)CC1
C(N1CCC(CC1)c1cnc2ccccc2n1)c1ccc(cc1)-c1nc2nccn2cc1-c1ccccc1
N#Cc1ccc2nc([nH]c2c1)C1CCN(Cc2ccc(cc2)-c2nc3ccnn3cc2-c2ccccc2)CC1
Cc1nc2nc(-c3ccc(CN4CCC(CC4)c4nc5ccc(F)cc5[nH]4)cc3)c(cn2n1)-c1ccccc1
Cc1nc2nc(-c3ccc(CN4CCC(CC4)c4nc5ccncc5[nH]4)cc3)c(cn2n1)-c1ccccc1
C(N1CCC(CC1)c1nc2cccnc2[nH]1)c1ccc(cc1)-c1nc2ccnn2cc1-c1ccccc1
FC(F)(F)c1ccc2nc([nH]c2c1)C1CCN(Cc2ccc(cc2)-c2nc3ccnn3cc2-c2ccccc2)CC1
Fc1ccc2nc([nH]c2c1)C1CCN(Cc2ccc(cc2)-c2nc3ccnn3cc2-c2ccccc2)CC1
Nc1ncnc2n(ncc12)C1CCN(Cc2ccc(cc2)-c2nc3ccnn3cc2-c2ccccc2)CC1
Cc1nc2nc(-c3ccc(CN4CCC(CC4)c4nc5ccc(cc5[nH]4)C#N)cc3)c(cn2n1)-c1ccccc1
Cc1nc2nc(-c3ccc(CN4CCC(CC4)c4nc5ccc(cc5[nH]4)C(F)(F)F)cc3)c(cn2n1)-c1ccccc1
Cc1nc2nc(-c3ccc(CN4CCC(CC4)n4ncc5c(N)ncnc45)cc3)c(cn2n1)-c1ccccc1
Cc1nc2nc(-c3ccc(CN4CCC(CC4)c4nc5cccnc5[nH]4)cc3)c(cn2n1)-c1ccccc1
Cc1nc2nc(-c3ccc(CN4CCC(C4)c4n[nH]c(n4)-c4ccccn4)cc3)c(cn2n1)-c1ccccc1
Cc1nc2nc(-c3ccc(CN4CCC(CC4)c4cnc5ccccc5n4)cc3)c(cn2n1)-c1ccccc1
Cc1cnc2nc(-c3ccc(CN4CC(C4)c4n[nH]c(n4)-c4cccc(C)n4)cc3)c(cn12)-c1ccccc1
Cc1nc2nc(-c3ccc(CN4CC(C4)c4n[nH]c(n4)-c4ccccn4)cc3)c(cn2c1Br)-c1ccccc1
COC(=O)c1cnn2cc(c(nc12)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2cccc(C)n2)cc1)-c1c(F)cccc1F |(-11.65,4.7,;-11.25,3.21,;-9.76,2.81,;-8.67,3.9,;-9.36,1.32,;-10.27,.08,;-9.36,-1.17,;-7.9,-.69,;-6.56,-1.46,;-5.23,-.69,;-5.23,.85,;-6.56,1.62,;-7.9,.85,;-3.9,1.62,;-2.56,.85,;-1.23,1.62,;-1.23,3.16,;.1,3.93,;1.44,3.16,;1.84,1.67,;3.32,2.07,;2.93,3.55,;4.66,1.3,;4.66,-.24,;6.12,-.72,;7.03,.53,;6.12,1.77,;8.57,.53,;9.34,-.81,;10.88,-.81,;11.65,.53,;10.88,1.86,;11.65,3.19,;9.34,1.86,;-2.56,3.93,;-3.9,3.16,;-4.46,-2.03,;-5.23,-3.36,;-6.77,-3.36,;-4.46,-4.7,;-2.92,-4.7,;-2.15,-3.36,;-2.92,-2.03,;-2.15,-.69,)|
COC(=O)c1cnn2cc(c(nc12)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2ccccn2)cc1)-c1c(F)cccc1F |(-11.65,4.7,;-11.25,3.21,;-9.76,2.81,;-8.67,3.9,;-9.36,1.32,;-10.27,.08,;-9.36,-1.17,;-7.9,-.69,;-6.56,-1.46,;-5.23,-.69,;-5.23,.85,;-6.56,1.62,;-7.9,.85,;-3.9,1.62,;-2.56,.85,;-1.23,1.62,;-1.23,3.16,;.1,3.93,;1.44,3.16,;1.84,1.67,;3.32,2.07,;2.93,3.55,;4.66,1.3,;4.66,-.24,;6.12,-.72,;7.03,.53,;6.12,1.77,;8.57,.53,;9.34,-.81,;10.88,-.81,;11.65,.53,;10.88,1.86,;9.34,1.86,;-2.56,3.93,;-3.9,3.16,;-4.46,-2.03,;-5.23,-3.36,;-6.77,-3.36,;-4.46,-4.7,;-2.92,-4.7,;-2.15,-3.36,;-2.92,-2.03,;-2.15,-.69,)|
CC(C)c1nc2nc(-c3ccc(CN4CC(C4)c4n[nH]c(n4)-c4ccccn4)cc3)c(cn2n1)-c1ccccc1
CC(C)c1nc2nc(-c3ccc(CN4CCC(CC4)c4cnc5ccccc5n4)cc3)c(cn2n1)-c1ccccc1
CC(C)c1nc2nc(-c3ccc(CN4CC(C4)c4n[nH]c(n4)-c4cccc(C)n4)cc3)c(cn2n1)-c1ccccc1
COC(=O)c1cnn2cc(-c3ccc(F)cc3F)c(nc12)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2ccccn2)cc1
Fc1ccc(cc1)-c1cn2ccnc2nc1-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2ccccn2)cc1
Fc1ccc(cc1)-c1cn2ccnc2nc1-c1ccc(CN2CCC(CC2)c2cnc3ccccc3n2)cc1
Cc1nc2nc(-c3ccc(CN4CC(C4)c4n[nH]c(n4)-c4cccc(C)n4)cc3)c(cn2n1)-c1ccc(F)cc1F
Cc1cn2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2cnc3ccccc3n2)cc1
Cc1cn2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2cccc(C)n2)cc1
Cc1cccc(n1)-c1nc(n[nH]1)C1CN(Cc2ccc(cc2)-c2nc3nc(nn3cc2-c2ccc(F)cc2)C2CC2)C1
C(N1CCC(CC1)c1cnc2ccccc2n1)c1ccc(cc1)-c1nc2nc(nn2cc1-c1ccccc1)C1CC1
Cc1cccc(n1)-c1nc(n[nH]1)C1CN(Cc2ccc(cc2)-c2nc3nc(nn3cc2-c2ccccc2)C2CC2)C1
CCc1cnn2cc(-c3ccccc3)c(nc12)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2cccc(C)n2)cc1
CNc1nc2nc(-c3ccc(CN4CC(C4)c4n[nH]c(n4)-c4ccccn4)cc3)c(cn2n1)-c1ccccc1
CC(C)Nc1nc2nc(-c3ccc(CN4CC(C4)c4n[nH]c(n4)-c4ccccn4)cc3)c(cn2n1)-c1ccccc1
Cc1nc2nc(-c3ccc(CN4CC(C4)c4n[nH]c(n4)-c4ccccn4)cc3)c(-c3ccccc3)c(C)n2n1
Cc1nc2nc(-c3ccc(CN4CC(C4)c4n[nH]c(n4)-c4cccc(C)n4)cc3)c(-c3ccccc3)c(C)n2n1
Cc1nc2nc(-c3ccc(CN4CC(C4)c4n[nH]c(n4)-c4ccccn4)cc3)c(-c3ccccc3)c(NC3CCC3)n2n1
CNc1c(-c2ccccc2)c(nc2nc(C)nn12)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2cccc(C)n2)cc1
CC(C)Nc1c(-c2ccccc2)c(nc2nc(C)nn12)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2ccccn2)cc1
COC(=O)c1cnn2cc(c(nc12)-c1ccc(CN2CCC(CC2)c2n[nH]c(n2)-c2cccc(C)n2)cc1)-c1c(F)cccc1F |(-11.96,4.7,;-11.56,3.21,;-10.07,2.81,;-8.98,3.9,;-9.67,1.32,;-10.58,.08,;-9.67,-1.17,;-8.21,-.69,;-6.88,-1.46,;-5.54,-.69,;-5.54,.85,;-6.88,1.62,;-8.21,.85,;-4.21,1.62,;-2.88,.85,;-1.54,1.62,;-1.54,3.16,;-.21,3.93,;1.13,3.16,;1.13,1.62,;2.46,.85,;3.79,1.62,;3.79,3.16,;2.46,3.93,;5.13,.85,;5.13,-.69,;6.59,-1.17,;7.5,.08,;6.59,1.32,;8.98,.47,;10.07,-.61,;11.56,-.22,;11.96,1.27,;10.87,2.36,;11.27,3.85,;9.38,1.96,;-2.88,3.93,;-4.21,3.16,;-4.77,-2.03,;-5.54,-3.36,;-7.08,-3.36,;-4.77,-4.7,;-3.23,-4.7,;-2.46,-3.36,;-3.23,-2.03,;-2.46,-.69,)|
COC(=O)c1cnn2cc(c(nc12)-c1ccc(CN2CCC(CC2)c2n[nH]c(n2)-c2ccccn2)cc1)-c1c(F)cccc1F |(-11.96,4.7,;-11.56,3.21,;-10.07,2.81,;-8.98,3.9,;-9.67,1.32,;-10.58,.08,;-9.67,-1.17,;-8.21,-.69,;-6.88,-1.46,;-5.54,-.69,;-5.54,.85,;-6.88,1.62,;-8.21,.85,;-4.21,1.62,;-2.88,.85,;-1.54,1.62,;-1.54,3.16,;-.21,3.93,;1.13,3.16,;1.13,1.62,;2.46,.85,;3.79,1.62,;3.79,3.16,;2.46,3.93,;5.13,.85,;5.13,-.69,;6.59,-1.17,;7.5,.08,;6.59,1.32,;8.98,.47,;10.07,-.61,;11.56,-.22,;11.96,1.27,;10.87,2.36,;9.38,1.96,;-2.88,3.93,;-4.21,3.16,;-4.77,-2.03,;-5.54,-3.36,;-7.08,-3.36,;-4.77,-4.7,;-3.23,-4.7,;-2.46,-3.36,;-3.23,-2.03,;-2.46,-.69,)|
Cc1nc2nc(-c3ccc(CN4CCC(CC4)c4n[nH]c(n4)-c4cccc(C)n4)cc3)c(cn2n1)-c1cccc(F)c1
Cc1nc2nc(-c3ccc(CN4CCC(CC4)c4n[nH]c(n4)-c4ccccn4)cc3)c(cn2n1)-c1cccc(F)c1
Cc1nc2nc(-c3ccc(CN4CCC(CC4)c4n[nH]c(n4)-c4cc(Cl)ccn4)cc3)c(cn2n1)-c1ccc(F)cc1F
Cc1nc2nc(-c3ccc(CN4CCC(CC4)c4n[nH]c(n4)-c4cccc(C)n4)cc3)c(cn2n1)-c1ccc(F)cc1F
Cc1nc2nc(-c3ccc(CN4CCC(CC4)c4n[nH]c(n4)-c4cnccn4)cc3)c(cn2n1)-c1ccc(F)cc1F
Cc1cccc(n1)-c1nc(n[nH]1)C1CCN(Cc2ccc(cc2)-c2nc3nc(nn3cc2-c2ccc(F)cc2)C2CC2)CC1
Fc1ccc(cc1)-c1cn2nc(nc2nc1-c1ccc(CN2CCC(CC2)c2n[nH]c(n2)-c2ccccn2)cc1)C1CC1
Fc1ccc(cc1)-c1cn2nc(nc2nc1-c1ccc(CN2CCC(CC2)c2n[nH]c(n2)-c2cc(Cl)ccn2)cc1)C1CC1
Cc1cccc(n1)-c1nc(n[nH]1)C1CCN(Cc2ccc(cc2)-c2nc3nccn3cc2-c2ccc(F)cc2)CC1
Fc1ccc(cc1)-c1cn2ccnc2nc1-c1ccc(CN2CCC(CC2)c2n[nH]c(n2)-c2ccccn2)cc1
Fc1ccc(cc1)-c1cn2ccnc2nc1-c1ccc(CN2CCC(CC2)c2n[nH]c(n2)-c2cnccn2)cc1
Cc1cccc(n1)-c1nc(n[nH]1)C1CCN(Cc2ccc(cc2)-c2nc3ncc(Br)n3cc2-c2ccc(F)cc2)CC1
Fc1ccc(cc1)-c1cn2c(Cl)cnc2nc1-c1ccc(CN2CCC(CC2)c2n[nH]c(n2)-c2ccccn2)cc1
Cc1cccc(n1)-c1nc(n[nH]1)C1CCN(Cc2ccc(cc2)-c2nc3nccn3cc2-c2ccccc2F)CC1
Brc1cnc2nc(-c3ccc(CN4CC(C4)c4n[nH]c(n4)-c4ccccn4)cc3)c(cn12)-c1ccccc1
Cc1cn2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2ccccn2)cc1
Cc1nc2nc(-c3ccc(CN4CC(C4)c4n[nH]c(n4)-c4cccc(C)n4)cc3)c(cn2c1Br)-c1ccccc1
CNc1c(-c2ccccc2)c(nc2nccn12)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2ccccn2)cc1
CNc1c(-c2ccccc2)c(nc2ncc(Br)n12)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2ccccn2)cc1
CNc1c(-c2ccccc2)c(nc2nc(C)cn12)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2ccccn2)cc1
CNc1c(-c2ccccc2)c(nc2nc(C)cn12)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2cccc(C)n2)cc1
OCc1cnn2cc(c(nc12)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2ccccn2)cc1)-c1c(F)cccc1F |(-10.7,-2.37,;-9.22,-2.77,;-8.82,-4.26,;-9.72,-5.51,;-8.82,-6.75,;-7.35,-6.28,;-6.02,-7.05,;-4.69,-6.28,;-4.69,-4.74,;-6.02,-3.97,;-7.35,-4.74,;-3.35,-3.97,;-2.02,-4.74,;-.69,-3.97,;-.69,-2.43,;.65,-1.66,;1.98,-2.43,;2.38,-3.91,;3.87,-3.51,;3.47,-2.03,;5.2,-4.28,;5.2,-5.82,;6.67,-6.3,;7.57,-5.05,;6.67,-3.81,;9.06,-4.66,;10.15,-5.74,;11.64,-5.35,;12.03,-3.86,;10.95,-2.77,;9.46,-3.17,;-2.02,-1.66,;-3.35,-2.43,;-3.6,-7.36,;-4,-8.85,;-5.48,-9.25,;-2.91,-9.94,;-1.42,-9.54,;-1.02,-8.06,;-2.11,-6.97,;-1.71,-5.48,)|
COc1nn2cc(c(nc2c1CO)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2ccccn2)cc1)-c1c(F)cccc1F |(-12.03,-6.84,;-11.26,-5.51,;-9.72,-5.51,;-8.82,-6.75,;-7.35,-6.28,;-6.02,-7.05,;-4.69,-6.28,;-4.69,-4.74,;-6.02,-3.97,;-7.35,-4.74,;-8.82,-4.26,;-9.22,-2.77,;-10.7,-2.37,;-3.35,-3.97,;-2.02,-4.74,;-.69,-3.97,;-.69,-2.43,;.65,-1.66,;1.98,-2.43,;2.38,-3.91,;3.87,-3.51,;3.47,-2.03,;5.2,-4.28,;5.2,-5.82,;6.67,-6.3,;7.57,-5.05,;6.67,-3.81,;9.06,-4.66,;10.15,-5.74,;11.64,-5.35,;12.03,-3.86,;10.95,-2.77,;9.46,-3.17,;-2.02,-1.66,;-3.35,-2.43,;-3.6,-7.36,;-4,-8.85,;-5.48,-9.25,;-2.91,-9.94,;-1.42,-9.54,;-1.02,-8.06,;-2.11,-6.97,;-1.71,-5.48,)|
COc1nn2cc(c(nc2c1CO)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2cccc(C)n2)cc1)-c1c(F)cccc1F |(-12.03,-1.23,;-11.26,.11,;-9.72,.11,;-8.82,-1.14,;-7.35,-.66,;-6.02,-1.43,;-4.69,-.66,;-4.69,.88,;-6.02,1.65,;-7.35,.88,;-8.82,1.35,;-9.22,2.84,;-10.7,3.24,;-3.35,1.65,;-2.02,.88,;-.69,1.65,;-.69,3.19,;.65,3.96,;1.98,3.19,;2.38,1.7,;3.87,2.1,;3.47,3.58,;5.2,1.33,;5.2,-.21,;6.67,-.69,;7.57,.56,;6.67,1.8,;9.06,.96,;10.15,-.13,;11.64,.27,;12.03,1.75,;10.95,2.84,;11.34,4.33,;9.46,2.44,;-2.02,3.96,;-3.35,3.19,;-3.6,-1.75,;-4,-3.24,;-5.48,-3.64,;-2.91,-4.33,;-1.42,-3.93,;-1.02,-2.44,;-2.11,-1.35,;-1.71,.13,)|
COc1nn2cc(c(nc2c1CO)-c1ccc(CN2CCC(CC2)c2n[nH]c(n2)-c2cccc(C)n2)cc1)-c1c(F)cccc1F |(-12.42,-1.04,;-11.65,.29,;-10.11,.29,;-9.21,-.95,;-7.74,-.48,;-6.41,-1.25,;-5.08,-.48,;-5.08,1.06,;-6.41,1.83,;-7.74,1.06,;-9.21,1.54,;-9.61,3.03,;-11.1,3.42,;-3.74,1.83,;-2.41,1.06,;-1.08,1.83,;-1.08,3.37,;.26,4.14,;1.59,3.37,;1.59,1.83,;2.92,1.06,;4.26,1.83,;4.26,3.37,;2.92,4.14,;5.59,1.06,;5.59,-.48,;7.06,-.95,;7.96,.29,;7.06,1.54,;9.45,.69,;10.54,-.4,;12.03,0,;12.42,1.49,;11.34,2.58,;11.73,4.06,;9.85,2.18,;-2.41,4.14,;-3.74,3.37,;-3.99,-1.57,;-4.39,-3.05,;-5.87,-3.45,;-3.3,-4.14,;-1.81,-3.74,;-1.41,-2.26,;-2.5,-1.17,;-2.1,.32,)|
COc1nn2cc(c(nc2c1CO)-c1ccc(CN2CCC(CC2)c2n[nH]c(n2)-c2ccccn2)cc1)-c1c(F)cccc1F |(-12.42,-1.04,;-11.65,.29,;-10.11,.29,;-9.21,-.95,;-7.74,-.48,;-6.41,-1.25,;-5.08,-.48,;-5.08,1.06,;-6.41,1.83,;-7.74,1.06,;-9.21,1.54,;-9.61,3.03,;-11.1,3.42,;-3.74,1.83,;-2.41,1.06,;-1.08,1.83,;-1.08,3.37,;.26,4.14,;1.59,3.37,;1.59,1.83,;2.92,1.06,;4.26,1.83,;4.26,3.37,;2.92,4.14,;5.59,1.06,;5.59,-.48,;7.06,-.95,;7.96,.29,;7.06,1.54,;9.45,.69,;10.54,-.4,;12.03,0,;12.42,1.49,;11.34,2.58,;9.85,2.18,;-2.41,4.14,;-3.74,3.37,;-3.99,-1.57,;-4.39,-3.05,;-5.87,-3.45,;-3.3,-4.14,;-1.81,-3.74,;-1.41,-2.26,;-2.5,-1.17,;-2.1,.32,)|
CC(C)Nc1c(-c2ccccc2)c(nc2nc(C)cn12)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2ccccn2)cc1
CC(C)Nc1c(-c2ccccc2)c(nc2nc(C)cn12)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2cccc(C)n2)cc1
CC(C)Nc1c(-c2ccccc2)c(nc2nccn12)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2ccccn2)cc1
CNc1c(-c2ccccc2)c(nc2nc(nn12)-c1ccccn1)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2ccccn2)cc1
CC(C)Nc1c(-c2ccccc2)c(nc2nc(nn12)-c1ccccn1)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2ccccn2)cc1
CC(C)Nc1c(-c2ccccc2)c(nc2nc(nn12)-c1ccccn1)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2cccc(C)n2)cc1
C(N1CC(C1)c1n[nH]c(n1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(nn2cc1-c1ccccc1)C1CC1
CSc1nc2nc(-c3ccc(CN4CC(C4)c4n[nH]c(n4)-c4cccc(C)n4)cc3)c(cn2n1)-c1ccccc1
CSc1nc2nc(-c3ccc(CN4CC(C4)c4n[nH]c(n4)-c4ccccn4)cc3)c(cn2n1)-c1ccccc1
CSc1nc2nc(-c3ccc(CN4CCC(CC4)c4n[nH]c(n4)-c4ccccn4)cc3)c(cn2n1)-c1ccccc1
CSc1nc2nc(-c3ccc(CN4CCC(CC4)c4n[nH]c(n4)-c4ncccn4)cc3)c(cn2n1)-c1ccccc1
CSc1nc2nc(-c3ccc(CN4CCC(CC4)c4n[nH]c(n4)-c4cnccn4)cc3)c(cn2n1)-c1ccccc1
CSc1nc2nc(-c3ccc(CN4CCC(CC4)c4n[nH]c(n4)-c4cccc(C)n4)cc3)c(cn2n1)-c1ccccc1
CS(=O)(=O)c1nc2nc(-c3ccc(CN4CCC(CC4)c4n[nH]c(n4)-c4ccccn4)cc3)c(cn2n1)-c1ccccc1
COC(=O)c1cn2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2cccc(C)n2)cc1
COC(=O)c1cn2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2ccccn2)cc1
OCc1cn2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CC(C2)c2n[nH]c(n2)-c2ccccn2)cc1
Cc1nc2nc(-c3ccc(CN4CCC(CC4)c4n[nH]c(n4)-c4ccccn4)cc3)c(cn2n1)-c1cc(F)ccc1F
NC1(CCC1)c1ccc(cc1)-c1nc2ncccn2c1-c1ccccc1
Cc1ccn2c(c(nc2n1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2nc(ccn2c1-c1ccccc1)C1CC1
NC1(CCC1)c1ccc(cc1)-c1nc2nc(ccn2c1-c1ccccc1)-c1ccccc1
Cc1ccccc1-c1ccn2c(c(nc2n1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
Cc1cnc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
COc1cnc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
CCOc1cnc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2ncc(cn2c1-c1ccccc1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(cn2c1-c1ccccc1)C#N
NC1(CCC1)c1ccc(cc1)-c1nc2cc(ccn2c1-c1ccccc1)-n1cccn1
COC(=O)c1cc(OC)c2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
COc1cc(cn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1)C(N)=O
CNC(=O)Nc1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2nc(ccn2c1-c1ccccc1)-n1ccccc1=O
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(cn2c1-c1ccccc1)-n1cccn1
COc1ccn2c(c(nc2n1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2nc(O)ccn2c1-c1ccccc1
CCCOc1ccn2c(c(nc2n1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c(cccn2c1-c1ccccc1)C#N
Cc1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
Cc1cccn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(ccn2c1-c1ccccc1)C#N
Cc1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
COc1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
CNC(=O)c1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
COCc1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
COc1cccn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
CC(O)c1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(CO)ccn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c(CO)cccn2c1-c1ccccc1
COc1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC(=O)c1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
CCOc1cccn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
CCc1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(ccn2c1-c1ccccc1)-c1cn[nH]c1
COC(=O)c1cccn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
COCCNCc1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(CO)cn2c1-c1ccccc1
COc1ccc(COc2ccn3c(c(nc3n2)-c2ccc(cc2)C2(N)CCC2)-c2ccccc2)cn1
COCCOc1ccn2c(c(nc2n1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
COc1cc(COc2ccn3c(c(nc3n2)-c2ccc(cc2)C2(N)CCC2)-c2ccccc2)ccn1
CCOc1ccn2c(c(nc2n1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
CC(C)Oc1ccn2c(c(nc2n1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2nc(OC3CCCCC3)ccn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2nc(Oc3ccccc3)ccn2c1-c1ccccc1
CCc1cnc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(ccn2c1-c1ccccc1)-c1ccc(F)cc1
COC(=O)c1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
COC(=O)c1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(ccn2c1-c1ccccc1)C1CC1
CCc1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2c(Br)cccn2c1-c1ccccc1
NC(=O)c1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(ccn2c1-c1ccccc1)C(=O)N1CCCC1
CCOC(=O)c1cccn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c(F)cccn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c(Cl)cccn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(F)cn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c(cccn2c1-c1ccccc1)C1CC1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(C=C)cn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c(C=C)cccn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c(cccn2c1-c1ccccc1)-c1cn[nH]c1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(cn2c1-c1ccccc1)C(O)=O
COc1cc(Br)cn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
CC(C)NC(=O)c1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(cn2c1-c1ccccc1)C(=O)NCCF
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(cn2c1-c1ccccc1)C(=O)NCCO
COCCNC(=O)c1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(cn2c1-c1ccccc1)C(=O)NC1CC1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(cn2c1-c1ccccc1)C(=O)NCC1CC1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(cn2c1-c1ccccc1)C(=O)NO
COC(=O)c1cc(Cl)c2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
CN(C)C(=O)c1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
CCNC(=O)c1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(cn2c1-c1ccccc1)C1CC1
NC1(CCC1)c1ccc(cc1)-c1nc2nc(OCCN3CCCC3=O)ccn2c1-c1ccccc1
NC(=O)C1(COc2ccn3c(c(nc3n2)-c2ccc(cc2)C2(N)CCC2)-c2ccccc2)CC1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(Cl)ccn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(F)ccn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c(cccn2c1-c1ccccc1)-c1ccc(F)cc1
NC1(CCC1)c1ccc(cc1)-c1nc2c(cccn2c1-c1ccccc1)-c1cccc(F)c1
COc1cncc(c1)-c1cccn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c(cccn2c1-c1ccccc1)-c1ccn[nH]1
NC1(CCC1)c1ccc(cc1)-c1nc2c(cccn2c1-c1ccccc1)-c1ccc2cn[nH]c2c1
Cc1cc(C)c2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
Cc1ccn2c(c(nc2c1Cl)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c(F)cc(F)cn2c1-c1ccccc1
Cc1cc(Cl)cn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
CCOC(=O)c1cc(Br)c2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2c(Cl)cc(Cl)cn2c1-c1ccccc1
COc1ccn2c(c(nc2c1C#N)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(Cl)c(Cl)cn2c1-c1ccccc1
Cc1c(Cl)cn2c(c(nc2c1Br)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
Cc1cc(Br)c2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2c(Br)cc(Cl)cn2c1-c1ccccc1
Cc1c(Cl)cn2c(c(nc2c1-c1ccc(F)cc1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
Cc1c(Cl)cn2c(c(nc2c1-c1ccn[nH]1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
Cc1c(C)c2nc(c(-c3ccccc3)n2cc1-c1ccn[nH]1)-c1ccc(cc1)C1(N)CCC1
Cc1cc(-c2cccnc2)c2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
COc1cncc(c1)-c1cc(C)cn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
Cc1cc(-c2ccn[nH]2)c2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
Cc1cc(-c2cn[nH]c2)c2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC(=O)c1cc(Br)c2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
Cc1cc(C(N)=O)c2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC(=O)c1cc(cn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1)-c1cn[nH]c1
NC(=O)c1cc(cn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1)-c1ccn[nH]1
NC(=O)c1cc(cn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1)-c1cccnc1
Cc1c(C)c2nc(c(-c3ccccc3)n2cc1C(N)=O)-c1ccc(cc1)C1(N)CCC1
Cc1cc(cn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1)C(N)=O
Cc1cc(cn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1)-c1cn[nH]c1
Cc1cc(cn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1)-c1ccn[nH]1
Cc1cc(cn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1)-c1cccnc1
Cc1cc([nH]n1)-c1cc(C)c2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2ccccn2c1-c1ccccc1
CCOc1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(C=C)ccn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(ccn2c1-c1ccccc1)-c1ccncc1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(ccn2c1-c1ccccc1)-c1cccnc1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(ccn2c1-c1ccccc1)-c1ccccn1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(ccn2c1-c1ccccc1)-c1cc[nH]n1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(ccn2c1-c1ccccc1)-c1ncc[nH]1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(ccn2c1-c1ccccc1)-c1cnc[nH]1
Cn1cncc1-c1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(ccn2c1-c1ccccc1)-c1nn[nH]n1
CCOC(=O)c1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(ccn2c1-c1ccccc1)C(O)=O
CNC(=O)c1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
COC(=O)\C=C\c1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC(=O)\C=C\c1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
COC(=O)CCc1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
CCNC(=O)c1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(ccn2c1-c1ccccc1)C(=O)NO
CC(=O)c1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(cn2c1-c1ccccc1)-c1cnc[nH]1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(cn2c1-c1ccccc1)-c1ncc[nH]1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(cn2c1-c1ccccc1)-c1cc[nH]n1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(cn2c1-c1ccccc1)-c1cn[nH]c1
Cn1cncc1-c1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
Cn1cc(cn1)-c1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(cn2c1-c1ccccc1)-c1nn[nH]n1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(cn2c1-c1ccccc1)-c1ccncc1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(cn2c1-c1ccccc1)-c1cccnc1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(cn2c1-c1ccccc1)-c1ccccn1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(Br)cn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(Cl)cn2c1-c1ccccc1
COC(=O)\C=C\c1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC(=O)\C=C\c1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
CCOC(=O)c1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
CC(=O)c1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
COc1cc(Cl)cn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
COc1cc(OC)c2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
CCc1cc(OC)c2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
COc1cc(cn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1)-c1cnc[nH]1
COc1cc(cn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1)-c1ncc[nH]1
Cn1cc(cn1)-c1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
Nc1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
CC(=O)Nc1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC(=O)Nc1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
CON(C)C(=O)c1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
Nc1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
CC(=O)Nc1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC(=O)Nc1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
CNC(=O)Nc1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
CS(=O)(=O)Nc1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
COc1cc(C=C)cn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
N[C@@]1(C[C@H](O)C1)c1ccc(cc1)-c1nc2nc(O)ccn2c1-c1ccccc1 |r,wD:1.0,3.3,(6.48,1.51,;5.14,2.28,;4.06,3.37,;5.14,4.46,;5.14,6,;6.23,3.37,;3.81,1.51,;3.81,-.03,;2.48,-.8,;1.14,-.03,;1.14,1.51,;2.48,2.28,;-.19,-.8,;-1.6,-.17,;-2.63,-1.32,;-4.17,-1.32,;-4.94,-2.65,;-6.48,-2.65,;-4.17,-3.99,;-2.63,-3.99,;-1.86,-2.65,;-.35,-2.33,;.74,-3.42,;.34,-4.91,;1.43,-6,;2.92,-5.6,;3.31,-4.11,;2.22,-3.02,)|
NC1(CCC1)c1ccc(cc1)-c1nc2nc(OCCN3C(=O)c4ccccc4C3=O)ccn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(O)cn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c(O)cccn2c1-c1ccccc1
NC(=O)c1cccn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC(=O)c1cc(Cl)c2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(ccn2c1-c1ccccc1)C#C
NC(=O)CCc1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
COC(=O)COc1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC(=O)COc1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
CN(C)C(=O)COc1ccn2c(c(nc2c1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(OC[N+]#[C-])ccn2c1-c1ccccc1
COC(=O)COc1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(OC[N+]#[C-])cn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2cc(O)ccn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(cn2c1-c1ccccc1)-c1cccnc1O
Cc1cc([nH]n1)-c1ccc2nc(c(-c3ccccc3)n2c1)-c1ccc(cc1)C1(N)CCC1
COc1cc(cn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1)-c1cn[nH]c1
Cc1cccc2nc(c(-c3ccccc3)n12)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2c(Cl)cc(cn2c1-c1ccccc1)C#N
NC1(CCC1)c1ccc(cc1)-c1nn2ccnc2cc1-c1ccccc1
Cc1cn2nc(-c3ccc(cc3)C3(N)CCC3)c(cc2n1)-c1ccccc1
Cc1cnc2cc(-c3ccccc3)c(nn12)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nn2c(cnc2cc1-c1ccccc1)-c1cccc(c1)C#N
CS(=O)(=O)c1ccc(cc1)-c1cnc2cc(-c3ccccc3)c(nn12)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nn2c(cnc2cc1-c1ccccc1)-c1ccc(cc1)C#N
COC(=O)c1cccc(c1)-c1cnc2cc(-c3ccccc3)c(nn12)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nn2c(cnc2cc1-c1ccccc1)-c1ccc(F)cc1
Cc1ccc(cc1)-c1cnc2cc(-c3ccccc3)c(nn12)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nn2c(cnc2cc1-c1ccccc1)-c1cccc(CO)c1
NC1(CCC1)c1ccc(cc1)-c1nn2c(cnc2cc1-c1ccccc1)-c1ccc(CO)cc1
NC1(CCC1)c1ccc(cc1)-c1nn2c(cnc2cc1-c1ccccc1)-c1ccc(cc1)S(N)(=O)=O
NC1(CCC1)c1ccc(cc1)-c1nn2c(Br)cnc2cc1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nn2c(cnc2cc1-c1ccccc1)-c1ccc(F)c(CO)c1
NC(=O)c1ccc(cc1)-c1cnc2cc(-c3ccccc3)c(nn12)-c1ccc(cc1)C1(N)CCC1
NC(=O)c1cccc(c1)-c1cnc2cc(-c3ccccc3)c(nn12)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nn2c(cnc2cc1-c1ccccc1)-c1cn[nH]c1
NC1(CCC1)c1ccc(cc1)-c1nn2c(cnc2cc1-c1ccccc1)-c1ccc(O)nc1
COC(=O)c1ccc(cn1)-c1cnc2cc(-c3ccccc3)c(nn12)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nn2c(cnc2cc1-c1ccccc1)-c1ccn[nH]1
NC1(CCC1)c1ccc(cc1)-c1nn2c(cnc2cc1-c1ccccc1)-c1ccc2cn[nH]c2c1
CCOC(=O)c1cncc(c1)-c1cnc2cc(-c3ccccc3)c(nn12)-c1ccc(cc1)C1(N)CCC1
COc1cncc(c1)-c1cnc2cc(-c3ccccc3)c(nn12)-c1ccc(cc1)C1(N)CCC1
Cc1nc2cc(-c3ccccc3)c(nn2c1-c1cccc(c1)C(N)=O)-c1ccc(cc1)C1(N)CCC1
Cc1nc2cc(-c3ccccc3)c(nn2c1-c1ccc(F)c(CO)c1)-c1ccc(cc1)C1(N)CCC1
Cc1nc2cc(-c3ccccc3)c(nn2c1-c1cn[nH]c1)-c1ccc(cc1)C1(N)CCC1
Cc1nc2cc(-c3ccccc3)c(nn2c1-c1ccc(F)cc1)-c1ccc(cc1)C1(N)CCC1
Cc1nc2cc(-c3ccccc3)c(nn2c1-c1ccc(cc1)C(N)=O)-c1ccc(cc1)C1(N)CCC1
Cc1nc2cc(-c3ccccc3)c(nn2c1-c1ccn[nH]1)-c1ccc(cc1)C1(N)CCC1
Cc1cc([nH]n1)-c1c(C)nc2cc(-c3ccccc3)c(nn12)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nn2c(c(Br)nc2cc1-c1ccccc1)-c1ccc(F)cc1
NC1(CCC1)c1ccc(cc1)-c1nn2c(c(Cl)nc2cc1-c1ccccc1)-c1ccc(F)cc1
NC(=O)\C=C\c1cnc2cc(-c3ccccc3)c(nn12)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nn2c(C=C)cnc2cc1-c1ccccc1
Cc1nc2cc(-c3ccccc3)c(nn2c1\C=C\C(N)=O)-c1ccc(cc1)C1(N)CCC1
COC(=O)\C=C\c1c(C)nc2cc(-c3ccccc3)c(nn12)-c1ccc(cc1)C1(N)CCC1
Cc1nc2cc(-c3ccccc3)c(nn2c1C=C)-c1ccc(cc1)C1(N)CCC1
CCc1c(C)nc2cc(-c3ccccc3)c(nn12)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2c3cc(F)ccc3nn2cc1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c3cc(F)ccc3nn2c(NC2CC2)c1-c1ccccc1
CNc1c(-c2ccccc2)c(nc2c3cc(F)ccc3nn12)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2c3ccc(cc3nn2cc1-c1ccccc1)-c1cccc(c1)C#N
CS(=O)(=O)c1ccc(cc1)-c1ccc2c(c1)nn1cc(-c3ccccc3)c(nc21)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2c3ccc(cc3nn2cc1-c1ccccc1)-c1ccc(F)cc1
NC1(CCC1)c1ccc(cc1)-c1nc2c3ccc(Br)cc3nn2cc1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c3ccc(cc3nn2cc1-c1ccccc1)-c1ccc(F)c(CO)c1
NC1(CCC1)c1ccc(cc1)-c1nc2c3ccc(cc3nn2cc1-c1ccccc1)-c1ccc(F)c(O)c1
COc1cc(ccc1F)-c1ccc2c(c1)nn1cc(-c3ccccc3)c(nc21)-c1ccc(cc1)C1(N)CCC1
CS(=O)(=O)c1cccc(c1)-c1ccc2c(c1)nn1cc(-c3ccccc3)c(nc21)-c1ccc(cc1)C1(N)CCC1
COC(=O)c1ccc2c(c1)nn1cc(-c3ccccc3)c(nc21)-c1ccc(cc1)C1(N)CCC1
NC(=O)c1cccc(c1)-c1ccc2c(c1)nn1cc(-c3ccccc3)c(nc21)-c1ccc(cc1)C1(N)CCC1
NC(=O)c1ccc(cc1)-c1ccc2c(c1)nn1cc(-c3ccccc3)c(nc21)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2c3ccc(cc3nn2cc1-c1ccccc1)-c1cn[nH]c1
NC1(CCC1)c1ccc(cc1)-c1nc2c3ccc(cc3nn2cc1-c1ccccc1)-c1ccc(O)nc1
COC(=O)c1ccc(cn1)-c1ccc2c(c1)nn1cc(-c3ccccc3)c(nc21)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2c3cc(ccc3nn2cc1-c1ccccc1)-c1ccc(F)cc1
Cc1ccc(cc1)-c1ccc2nn3cc(-c4ccccc4)c(nc3c2c1)-c1ccc(cc1)C1(N)CCC1
COC(=O)c1cccc(c1)-c1ccc2nn3cc(-c4ccccc4)c(nc3c2c1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2c3cc(ccc3nn2cc1-c1ccccc1)-c1cccc(c1)C#N
NC1(CCC1)c1ccc(cc1)-c1nc2c3cc(Br)ccc3nn2cc1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c3cc(ccc3nn2cc1-c1ccccc1)-c1ccc(cc1)C#N
NC1(CCC1)c1ccc(cc1)-c1nc2c3cc(ccc3nn2cc1-c1ccccc1)-c1cccc(CO)c1
NC1(CCC1)c1ccc(cc1)-c1nc2c3cc(ccc3nn2cc1-c1ccccc1)-c1ccc(CO)cc1
NC1(CCC1)c1ccc(cc1)-c1nc2c3cc(ccc3nn2cc1-c1ccccc1)-c1ccc(cc1)S(N)(=O)=O
NC1(CCC1)c1ccc(cc1)-c1nc2c3cc(ccc3nn2cc1-c1ccccc1)-c1ccc(F)c(CO)c1
NC1(CCC1)c1ccc(cc1)-c1nc2c3cc(ccc3nn2cc1-c1ccccc1)-c1cn[nH]c1
NC1(CCC1)c1ccc(cc1)-c1nc2c3c(cccc3nn2cc1-c1ccccc1)-c1ccc(cc1)C#N
NC1(CCC1)c1ccc(cc1)-c1nc2c3cccc(-c4cccc(c4)C#N)c3nn2cc1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c3cccc(Br)c3nn2cc1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c3cccc(-c4ccc(F)cc4)c3nn2cc1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c3cccc(-c4ccc(CO)cc4)c3nn2cc1-c1ccccc1
CS(=O)(=O)c1cccc(c1)-c1cccc2c1nn1cc(-c3ccccc3)c(nc21)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2c3cccc(-c4cn[nH]c4)c3nn2cc1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c3cccc(C#N)c3nn2cc1-c1ccccc1
COC(=O)c1cccc2c1nn1cc(-c3ccccc3)c(nc21)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2c3cccc(O)c3nn2cc1-c1ccccc1
NC(=O)\C=C\c1cccc2c1nn1cc(-c3ccccc3)c(nc21)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2c3ccc(cc3nn2cc1-c1ccccc1)-c1ccn[nH]1
Cc1cc([nH]n1)-c1ccc2c(c1)nn1cc(-c3ccccc3)c(nc21)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2c3cc(ccc3nn2cc1-c1ccccc1)-c1ccn[nH]1
Cc1cc([nH]n1)-c1ccc2nn3cc(-c4ccccc4)c(nc3c2c1)-c1ccc(cc1)C1(N)CCC1
COC(=O)\C=C\c1ccc2nn3cc(-c4ccccc4)c(nc3c2c1)-c1ccc(cc1)C1(N)CCC1
NC(=O)\C=C\c1ccc2nn3cc(-c4ccccc4)c(nc3c2c1)-c1ccc(cc1)C1(N)CCC1
CCOC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1
Clc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1F
COc1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Fc1ccccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Cc1ccccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
COc1ccccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Fc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1F
Fc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Clc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1
COc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
FC(F)(F)c1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Brc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
COC(=O)c1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
OC(=O)c1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
CC(C)c1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Cc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1cccc(c1)C#N
Cc1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1Cl
Oc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1Br
Fc1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc(F)c1F
OCc1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1cccc(c1)C1CC1
Oc1ccccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
FC(F)Oc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
COc1cc(NC(=O)C(C)c2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Cc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1C
Cc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1F
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1cccc2ocnc12
FC(F)(F)Oc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
CC(C)Oc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
COc1cc(F)ccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CC(C)(C)OC(=O)NCCc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1C(F)(F)F
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1cccc(c1)C#C
Oc1cc(F)ccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1CCc2ccccc12
Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1C1CC1
Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1OC(F)(F)F
OCCOc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Ic1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
COC(=O)c1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
CCOc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
COc1c(F)ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1F
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1CCOc2ccccc12
[O-][N+](=O)c1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Oc1ccc(F)cc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CCOC(=O)Cc1nc(cc(=O)n1C)N1CCOCC1
Cn1c(CC(=O)Nc2ccc(F)c(Cl)c2)nc(cc1=O)N1CCOCC1
Cn1c(CC(=O)Nc2cccc(Br)c2)nc(cc1=O)N1CCOCC1
CC(C)(C)OC(=O)n1ccc2c(NC(=O)Cc3nc(cc(=O)[nH]3)N3CCOCC3)cccc12
COCc1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
CN(C)c1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c(F)c1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1ccsc1
Fc1cc(F)cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
CC(C)(C)c1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1C#N
Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)nc1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1cccnc1
Cc1cc(F)ccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1cccc(OC2CCCC2)c1
Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c(F)c1F
Fc1cc(F)c(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1F
Fc1c(Cl)cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1Cl
OC(=O)c1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c(Br)c1
CCn1c(CC(=O)Nc2ccc(F)cc2)nc(cc1=O)N1CCOCC1
CC(C)C(C(=O)Nc1ccc(F)cc1)c1nc(cc(=O)[nH]1)N1CCOCC1
Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1I
FC(F)C(F)(F)Oc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1
FC(F)c1cc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)ccc1F
Fc1ccc(NC(=O)C(F)(F)c2nc(cc(=O)[nH]2)N2CCOCC2)cc1
Cn1c(CC(=O)Nc2ccc(F)c(F)c2)nc(cc1=O)N1CCOCC1
Cn1c(CC(=O)N2CCc3ccccc23)nc(cc1=O)N1CCOCC1
Cn1c(CC(=O)Nc2ccc(F)c(Br)c2)nc(cc1=O)N1CCOCC1
Cn1c(CC(=O)Nc2ccc(F)c(CO)c2)nc(cc1=O)N1CCOCC1
Cn1c(CC(=O)Nc2cccc(c2)C2CC2)nc(cc1=O)N1CCOCC1
COc1cc(NC(=O)Cc2nc(cc(=O)n2C)N2CCOCC2)ccc1F
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1cccc2occc12
Cn1c(CC(=O)Nc2ccccc2)nc(cc1=O)N1CCOCC1
Cn1c(CC(=O)Nc2ccc(F)c(c2)C2CC2)nc(cc1=O)N1CCOCC1
Oc1c(F)cccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Clc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cc1C#C
Oc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Fc1cc2N(CCc2c(F)c1)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Cn1c(CC(=O)Nc2ccc(F)c(I)c2)nc(cc1=O)N1CCOCC1
Fc1ccc2N(CCc2c1F)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Fc1ccc2CCN(C(=O)Cc3nc(cc(=O)[nH]3)N3CCOCC3)c2c1
CC1Cc2ccccc2N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Cn1c(CC(=O)Nc2ccc(F)c(c2)C(F)F)nc(cc1=O)N1CCOCC1
Cn1c(CC(=O)Nc2cc(F)c(F)c(F)c2)nc(cc1=O)N1CCOCC1
Cn1ccc2c(NC(=O)Cc3nc(cc(=O)[nH]3)N3CCOCC3)cccc12
Cc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CC1CN(C(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c2ccccc12
Cn1c(CC(=O)N2CCc3c2cccc3F)nc(cc1=O)N1CCOCC1
Fc1ccc2N(CCc2c1)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Cn1c(CC(=O)N2CCc3c2cccc3Cl)nc(cc1=O)N1CCOCC1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1cccc2sccc12
OCC1Cc2ccccc2N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1ccccc1OCCN1CCCCC1
COCCOc1ccccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Cn1c(CC(=O)N2CCc3c2cccc3O)nc(cc1=O)N1CCOCC1
COc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)n1C)N1CCOCC1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1CCc2ccccc2C1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1ccccc1OCCN1CCCC1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1ccccc1OCc1cccnc1
Cc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)n1C)N1CCOCC1
CN(C)CC1CN(C(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c2ccccc12
Cn1c(CC(=O)N2CCc3c2cccc3Br)nc(cc1=O)N1CCOCC1
CC1CN(C(=O)Cc2nc(cc(=O)n2C)N2CCOCC2)c2ccccc12
COCC1Cc2ccccc2N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CCOc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
NC(=O)C1Cc2ccccc2N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CC1Cc2ccccc2N1C(=O)Cc1nc(cc(=O)n1C)N1CCOCC1
Cn1c(CC(=O)N2CCc3ccc(F)cc23)nc(cc1=O)N1CCOCC1
C[C@@H]1CN(C(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c2ccccc12 |r|
C[C@H]1CN(C(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c2ccccc12 |r|
Cn1c(CC(=O)N2CCc3cc(F)c(F)cc23)nc(cc1=O)N1CCOCC1
Cn1c(CC(=O)N2CCc3c2ccc(F)c3F)nc(cc1=O)N1CCOCC1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1Cc2ccccc2C1
Cn1c(CC(=O)Nc2cccc3sccc23)nc(cc1=O)N1CCOCC1
Clc1cccc2N(CCCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
OCc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Fc1ccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c(OCC2CCNCC2)c1
Clc1ccc2N(CCc2c1)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Brc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CN(C)C[C@H]1CN(C(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c2ccccc12 |r|
CN(C)C[C@@H]1CN(C(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c2ccccc12 |r|
COCCOc1cc(F)ccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1cccc2[nH]cnc12
COC(=O)c1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1O
COc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Oc1c(Br)cccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1cccc2NCCOc12
COC(=O)c1cc(F)ccc1NC(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CCN(CC)CC1CN(C(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c2ccccc12
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1CCc2ncccc12
Fc1cc2CCN(C(=O)Cc3nc(cc(=O)[nH]3)N3CCOCC3)c2cc1F
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)Nc1cccc2CCCNc12
Clc1cccc2N(CCOc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Cc1cccc(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c1O
Oc1c(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cccc1[N+]([O-])=O
Oc1c(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cccc1C#N
Oc1c(NC(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)cccc1C(F)(F)F
Oc1ccc(cc1O)-c1oc2cc(O)c(CN3CCOCC3)c(O)c2c(=O)c1O
CN(Cc1ccccc1)Cc1c(O)cc2oc(-c3ccc(O)c(O)c3)c(O)c(=O)c2c1O
c1cc2cnccc2c(c1)S(=O)(=O)NCCNC\C=C\c3ccc(cc3)Br
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc2NCCNC(=O)c2c1
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1cccc(N)c1 |r|
C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc2[nH]nc(N)c2c1 |r|
CC(C)S(=O)(=O)Nc1cccc(c1)-c1ccc2c(nc(nc2n1)N1CCOC[C@@H]1C)N1CCOC[C@@H]1C |r|
CNC(=O)C1CCN(CC1)c1nc(N2CCOC[C@@H]2C)c2ccc(nc2n1)-c1ccc(N)nc1 |r|
C[C@H]1COCCN1c1nc(nc2nc(ccc12)-c1ccc(N)nc1)N1CCOCC1 |r|
Fc1cccc2N(CCc12)C(=O)Cc1nc(N2CCOCC2)c(F)c(=O)[nH]1
CC(C(=O)N1CCc2c1cccc2F)c1nc(N2CCOCC2)c(F)c(=O)n1C
Cn1c(CC(=O)N2CCc3c2cccc3F)nc(N2CCOCC2)c(F)c1=O
C[C@@H]1Cc2ccccc2N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=O)[nH]1
C[C@H]1Cc2ccccc2N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=O)[nH]1
CC1Cc2cc(F)ccc2N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=O)[nH]1
C[C@H]1Cc2ccccc2N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=O)n1C
C[C@@H]1Cc2ccccc2N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=O)n1C
CC1Cc2c(cccc2F)N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=O)[nH]1
CC1Cc2cc(F)c(F)cc2N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=O)[nH]1
CC1Cc2cc(F)ccc2N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=O)n1C
CC1Cc2c(cccc2Br)N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=O)[nH]1
CC1Cc2c(cccc2Cl)N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=O)[nH]1
CC1Cc2c(ccc(F)c2F)N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=O)[nH]1
CC1Cc2c(cccc2F)N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=O)n1C
CC1Cc2c(ccc(F)c2F)N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=O)n1C
CC1Cc2cc(F)c(F)cc2N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=O)n1C
CC1Cc2c(cccc2Cl)N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=O)n1C
CC1Cc2c(cccc2Br)N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=O)n1C
CC1Cc2ccc(F)cc2N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=O)[nH]1
CC1Cc2c(ccc(F)c2Cl)N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=O)[nH]1
C[C@H]1Cc2ccccc2N1C(=O)Cc1nc(N2CCOCC2)c(Cl)c(=O)[nH]1
C[C@@H]1Cc2ccccc2N1C(=O)Cc1nc(N2CCOCC2)c(Cl)c(=O)[nH]1
C[C@H]1Cc2ccccc2N1C(=O)Cc1nc(N2CCOCC2)c(Br)c(=O)[nH]1
OCC1Cc2ccccc2N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=O)[nH]1
CC1CN(CCO1)c1cc(=O)[nH]c(CC(=O)Nc2ccc(F)cc2)n1
FCC1CN(CCO1)c1cc(=O)[nH]c(CC(=O)Nc2ccc(F)cc2)n1
Cn1c(CC(=O)Nc2ccc(F)c(Cl)c2)nc(cc1=O)N1CCOC(CF)C1
FCC1CN(CCO1)c1cc(=O)[nH]c(CC(=O)N2CCc3c2cccc3F)n1
CC1CN(CCO1)c1cc(=O)[nH]c(CC(=O)N2CCc3c2cccc3F)n1
Fc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOC2CCCC12
Fc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)-c1ccncc1
COc1cc(ccn1)-c1cc(=O)[nH]c(CC(=O)N2CCc3c2cccc3F)n1
CCC1CN(CCO1)c1cc(=O)[nH]c(CC(=O)Nc2ccc(F)cc2)n1
Cc1cc(ccn1)-c1cc(=O)[nH]c(CC(=O)N2CCc3c2cccc3F)n1
Fc1cc(ccn1)-c1cc(=O)[nH]c(CC(=O)N2CCc3c2cccc3F)n1
OCC1CN(CCO1)c1cc(=O)[nH]c(CC(=O)N2CCc3c2cccc3Cl)n1
OCC1CN(CCO1)c1cc(=O)[nH]c(CC(=O)N2CCc3c2cccc3F)n1
CC1CN(CCO1)c1cc(=O)[nH]c(CC(=O)N2CCc3c2cccc3Cl)n1
C[C@H]1Cc2ccccc2N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOC(C)C1
C[C@H]1Cc2ccccc2N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOC(CF)C1
C[C@H]1Cc2ccccc2N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOC(CO)C1
CC1Cc2c(cccc2Cl)N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Cn1c(CC(=O)N2CC(C)(C)c3c2cccc3Cl)nc(cc1=O)N1CCOCC1
CC1(C)CN(C(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c2cccc(Cl)c12
CC1Cc2c(cccc2O)N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Cn1c(CC(=O)N2CC(C)(C)c3c2cccc3F)nc(cc1=O)N1CCOCC1
CC1(C)CN(C(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c2cccc(F)c12
CC1CN(C(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)c2cccc(O)c12
CC1Cc2cc(F)ccc2N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CC1Cc2cc(F)ccc2N1C(=O)Cc1nc(cc(=O)n1C)N1CCOCC1
CC1Cc2c(ccc(F)c2F)N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CC1Cc2c(ccc(F)c2F)N1C(=O)Cc1nc(cc(=O)n1C)N1CCOCC1
CC1Cc2cc(F)c(F)cc2N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CC1Cc2cc(F)c(F)cc2N1C(=O)Cc1nc(cc(=O)n1C)N1CCOCC1
CC1Cc2c(cccc2Br)N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CC1Cc2c(cccc2F)N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CC1Cc2c(cccc2F)N1C(=O)Cc1nc(cc(=O)n1C)N1CCOCC1
CC1Cc2c(cccc2Br)N1C(=O)Cc1nc(cc(=O)n1C)N1CCOCC1
CC1Cc2c(cccc2Cl)N1C(=O)Cc1nc(cc(=O)n1C)N1CCOCC1
CC1Cc2ccc(F)cc2N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CC1Cc2c(ccc(F)c2Cl)N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CC(C)C1Cc2ccccc2N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CC(C(=O)N1CCc2c1cccc2F)c1nc(cc(=O)[nH]1)N1CCOCC1
CCC1Cc2ccccc2N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CC(F)(C(=O)N1CCc2c1cccc2F)c1nc(cc(=O)[nH]1)N1CCOCC1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1CCc2c1cccc2C#N
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1CC2(CC2)c2ccccc12
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1CCc2c1cccc2-c1ccccc1
FC(F)(F)Oc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Cn1c(CC(=O)N2CCc3c2cccc3C(F)(F)F)nc(cc1=O)N1CCOCC1
FC(F)(F)c1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
COc1ccccc1-c1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CCCN1CCCCC1c1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Cn1c(CC(=O)N2CCc3c2cccc3OC(F)F)nc(cc1=O)N1CCOCC1
FC(F)Oc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1CCc2c1cccc2-c1ccncc1
CN1CCC2(CN(C(=O)Cc3nc(cc(=O)[nH]3)N3CCOCC3)c3ccccc23)CC1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1CCc2c1cccc2-c1ccccn1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1CCc2c1cccc2-c1cccnc1
Clc1ccccc1-c1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Clc1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)n1C1CC1)N1CCOCC1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1C2CCCC2c2ccccc12
CS(=O)(=O)N1CCN(Cc2cccc3N(CCc23)C(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)CC1
CN1CCN(Cc2cccc3N(CCc23)C(=O)Cc2nc(cc(=O)[nH]2)N2CCOCC2)CC1
Fc1ccccc1-c1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CN1CCN(Cc2cccc3N(CCc23)C(=O)Cc2nc(cc(=O)n2C)N2CCOCC2)CC1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1CC2(CCOCC2)c2ccccc12
Cn1c(CC(=O)N2CC3(CCOCC3)c3ccccc23)nc(cc1=O)N1CCOCC1
Cn1c(CC(=O)N2CC3(CCNCC3)c3ccccc23)nc(cc1=O)N1CCOCC1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1C(Cc2ccccc12)c1ccccc1
CN1CCN(CC1)c1cccc2N(CCc12)C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
Fc1ccc(cc1)C1Cc2ccccc2N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CC1Cc2c(cccc2OC(F)F)N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
CC1Cc2c(cccc2OC(F)F)N1C(=O)Cc1nc(cc(=O)n1C)N1CCOCC1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1CCc2c1cccc2N1CCOCC1
O=C(Cc1nc(cc(=O)[nH]1)N1CCOCC1)N1C(Cc2ccccc12)C1CC1
CC1Cc2c(cccc2C(F)(F)F)N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
FCC1Cc2ccccc2N1C(=O)Cc1nc(cc(=O)[nH]1)N1CCOCC1
O=C(Cc1nc(cc(=O)n1-c1ccccc1)N1CCOCC1)N1CCc2ccccc12
Nn1c(CC(=O)N2CCc3ccccc23)nc(cc1=O)N1CCOCC1
O=C(Cc1nc(cc(=O)n1C#N)N1CCOCC1)N1CCc2ccccc12
C[C@H]1Cc2ccccc2N1C(=O)Cc1nc(cc(=S)[nH]1)N1CCOCC1
C[C@H]1Cc2ccccc2N1C(=S)Cc1nc(cc(=S)[nH]1)N1CCOCC1
C[C@@H]1Cc2ccccc2N1C(=O)Cc1nc(cc(=S)[nH]1)N1CCOCC1
C[C@H]1Cc2ccccc2N1C(=O)Cc1nc(cc(=S)n1C)N1CCOCC1
C[C@@H]1Cc2ccccc2N1C(=O)Cc1nc(cc(=S)n1C)N1CCOCC1
Cn1c(CC(=O)N2CCc3c2cccc3F)nc(cc1=S)N1CCOCC1
Cn1c(CC(=O)N2CCc3c2cccc3Cl)nc(cc1=S)N1CCOCC1
CC1Cc2c(ccc(F)c2F)N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=S)[nH]1
CC1Cc2c(ccc(F)c2F)N1C(=S)Cc1nc(N2CCOCC2)c(F)c(=S)[nH]1
C[C@H]1Cc2ccccc2N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=S)[nH]1
C[C@@H]1Cc2ccccc2N1C(=O)Cc1nc(N2CCOCC2)c(F)c(=S)[nH]1
NCC1CCCN(C1)c1ccc(C(N)=O)c2ncncc12
Cc1cccc(c1)N1CCC(CC1)Nc1ccc(C(N)=O)c2ncncc12
CN1CCC(C1)Nc1ccc(C(N)=O)c2ncncc12
CNCC1CCCN(C1)c1ccc(C(N)=O)c2ncncc12
NC(=O)c1ccc(NC[C@@H]2CCNC2)c2cncnc12 |r|
NC(=O)c1ccc(NC[C@H]2CCNC2)c2cncnc12 |r|
NC(=O)c1ccc(NCc2cccnc2)c2cncnc12
NC(=O)c1ccc(NCc2cccc(Cl)c2)c2cncnc12
NC(=O)c1ccc(N2CCC(CCc3ccccc3)C2)c2cncnc12
NC(=O)c1ccc(N2CCC(C2)OCc2ccccc2)c2cncnc12
NC(=O)c1ccc(N2CCC(O)(C2)c2ccccc2)c2cncnc12
Cc1cccc(c1)[C@@H]1CN(C[C@H]1CO)c1ccc(C(N)=O)c2ncncc12 |r|
CN(C)C(CNc1ccc(C(N)=O)c2ncncc12)c1cccc(Cl)c1
NC(=O)c1ccc(NCC(N2CCNCC2)c2ccccc2)c2cncnc12
NC(=O)c1ccc(NC2CCNCC2c2ccc(F)cc2)c2cncnc12
NC(=O)c1ccc(NC2CNCC2c2cccc(c2)C(F)(F)F)c2cncnc12
NC(=O)c1ccc(NC2CNCC2c2cccc(OC(F)(F)F)c2)c2cncnc12
Cc1cccc(c1)C1CCNCC1Nc1ccc(C(N)=O)c2ncncc12
NC(=O)c1ccc(NC2CNCCC2c2cccc(c2)C(F)(F)F)c2cncnc12
NC(=O)c1ccc(NC2CNCCC2c2ccc(Cl)c(F)c2)c2cncnc12
NC(=O)c1ccc(NC2CNCCC2c2ccc(F)c(Cl)c2)c2cncnc12
NC(=O)c1ccc(N[C@H]2CNCC[C@@H]2c2ccc(F)c(Cl)c2)c2cncnc12 |r|
NC(=O)c1ccc(N[C@@H]2CNCC[C@H]2c2ccc(F)c(Cl)c2)c2cncnc12 |r|
NC(=O)c1ccc(NC2CNCCC2c2ccc(F)cc2)c2cncnc12
NC(=O)c1ccc(N[C@H]2CNCC[C@@H]2c2ccc(F)cc2)c2cncnc12 |r|
NC(=O)c1ccc(N[C@@H]2CNCC[C@H]2c2ccc(F)cc2)c2cncnc12 |r|
NC(=O)c1ccc(N2CCN(CC2)c2ccc(cc2)C(F)(F)F)c2cncnc12
NC(=O)c1ccc(N2CCN(CC2)c2ccccc2)c2cncnc12
NC(=O)c1ccc(N2CCN(CC2)c2ccc(F)c(F)c2)c2cncnc12
NC(=O)c1ccc(N2CCN(CC2)c2ccc(F)c(Cl)c2)c2cncnc12
NC(=O)c1ccc(N2CCN(CC2)c2cccc(F)c2)c2cncnc12
NC(=O)c1ccc(N2CCN(CC2)c2cccc(Cl)c2)c2cncnc12
NC(=O)c1ccc(NCc2ccccc2)c2cncnc12
NC(=O)c1ccc(NCCc2ccccc2)c2cncnc12
NC(=O)c1ccc(NCCc2cccc(F)c2)c2cncnc12
NC(=O)c1ccc(NCCc2ccc(F)cc2)c2cncnc12
NC(=O)c1ccc(NCCc2ccc(F)c(F)c2)c2cncnc12
NC(=O)c1ccc(NCCCCc2ccccc2)c2cncnc12
CN(CCc1ccccc1)c1ccc(C(N)=O)c2ncncc12
NC(=O)c1ccc(NCCc2ccc(Cl)c(Cl)c2)c2cncnc12
NC(=O)c1ccc(N(CCc2ccccc2)[C@@H]2CCCNC2)c2cncnc12 |r|
NC1CN(CCC1c1cccc(c1)C(F)(F)F)c1ccc(C(N)=O)c2ncncc12
NC(=O)c1ccc(N2CCN(CC2)c2ccc(F)cc2)c2cncnc12
NC(=O)c1ccc(N2CCN(CC2)c2ccc(Cl)c(Cl)c2)c2cncnc12
Cc1ccc(Cl)cc1N1CCN(CC1)c1ccc(C(N)=O)c2ncncc12
Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1Br)-c1ccc(F)c(c1)C(F)(F)F
Nc1ncnc(N2CCC(CC2)c2nc(c[nH]2)-c2cccc(c2)C(F)(F)F)c1Br
FC(F)(F)c1cccc(c1)-c1c[nH]c(n1)C1CCN(CC1)c1ncncc1Br
Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C=O)-c1ccc(F)c(c1)C(F)(F)F
Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(c1)C(F)(F)F
CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(c1)C(F)(F)F
COc1c(N)ncnc1N1CCC(CC1)c1nc(cn1C)-c1ccc(F)c(c1)C(F)(F)F
Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1ccc(F)cc1)-c1ccc(F)c(c1)C(F)(F)F
COc1ccc(cc1)-c1c(N)ncnc1N1CCC(CC1)c1nc(cn1C)-c1ccc(F)c(c1)C(F)(F)F
Cc1ccc(cc1)-c1c(N)ncnc1N1CCC(CC1)c1nc(cn1C)-c1ccc(F)c(c1)C(F)(F)F
Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1ccc(CO)cc1)-c1ccc(F)c(c1)C(F)(F)F
Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1cccc(c1)C#N)-c1ccc(F)c(c1)C(F)(F)F
Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1ccc(cc1)C#N)-c1ccc(F)c(c1)C(F)(F)F
Cc1ccc(cn1)-c1c(N)ncnc1N1CCC(CC1)c1nc(cn1C)-c1ccc(F)c(c1)C(F)(F)F
Cc1ccc(s1)-c1c(N)ncnc1N1CCC(CC1)c1nc(cn1C)-c1ccc(F)c(c1)C(F)(F)F
Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1CO)-c1ccc(F)c(c1)C(F)(F)F
Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(c1)C(F)(F)F
CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(c1)C(F)(F)F
Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1ccncc1)-c1ccc(F)c(c1)C(F)(F)F
Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1ccc(N)nc1)-c1ccc(F)c(c1)C(F)(F)F
Cn1cc(nc1C1CCN(CC1)c1ncncc1Br)-c1ccc(F)c(c1)C(F)(F)F
Nc1ncnc(N2CCC(CC2)c2nc(c[nH]2)-c2ccc(F)c(c2)C(F)(F)F)c1Br
Nc1ncnc(N2CCC(CC2)c2nc(c[nH]2)-c2ccc(F)c(c2)C(F)(F)F)c1-c1ccc(F)cc1
Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1cncnc1)-c1ccc(F)c(c1)C(F)(F)F
Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1cccnc1)-c1ccc(F)c(c1)C(F)(F)F
COC\C=C\c1c(N)ncnc1N1CCC(CC1)c1nc(cn1C)-c1ccc(F)c(c1)C(F)(F)F
Cc1ncc(s1)-c1c(N)ncnc1N1CCC(CC1)c1nc(cn1C)-c1ccc(F)c(c1)C(F)(F)F
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1Br
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1-c1ccc(F)cc1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1-c1ccccc1F |(3.07,-8.47,;1.74,-7.7,;.4,-8.47,;-.93,-7.7,;-.93,-6.16,;.4,-5.39,;.4,-3.85,;1.74,-3.08,;1.74,-1.54,;.4,-.77,;-.93,-1.54,;-.93,-3.08,;.4,.77,;1.65,1.67,;1.17,3.14,;-.37,3.14,;-.84,1.67,;-2.18,.9,;-3.51,1.67,;-4.84,.9,;-5.32,-.56,;-6.86,-.56,;-7.33,.9,;-6.09,1.81,;1.94,4.47,;1.17,5.8,;1.94,7.14,;3.48,7.14,;4.25,8.47,;4.25,5.8,;3.48,4.47,;5.79,5.8,;6.56,7.14,;6.56,4.47,;7.33,5.8,;1.74,-6.16,;3.07,-5.39,;3.07,-3.85,;4.41,-3.08,;5.74,-3.85,;5.74,-5.39,;4.41,-6.16,;4.41,-7.7,)|
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1-c1ccc(F)c(F)c1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1C=C
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1Br
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1-c1ccc(F)cc1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1-c1ccccc1F |(3.16,-8.47,;1.83,-7.7,;.49,-8.47,;-.84,-7.7,;-.84,-6.16,;.49,-5.39,;.49,-3.85,;1.83,-3.08,;1.83,-1.54,;.49,-.77,;-.84,-1.54,;-.84,-3.08,;.49,.77,;1.74,1.67,;1.26,3.14,;-.28,3.14,;-.75,1.67,;-2.09,.9,;-3.42,1.67,;-4.75,.9,;-6.09,1.67,;-7.42,.9,;-7.42,-.64,;-6.09,-1.41,;-4.75,-.64,;2.03,4.47,;1.26,5.8,;2.03,7.14,;3.57,7.14,;4.34,8.47,;4.34,5.8,;3.57,4.47,;5.88,5.8,;7.42,5.8,;6.65,7.14,;6.65,4.47,;1.83,-6.16,;3.16,-5.39,;3.16,-3.85,;4.49,-3.08,;5.83,-3.85,;5.83,-5.39,;4.49,-6.16,;4.49,-7.7,)|
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1-c1cccc(F)c1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1C=C
Nc1cc(ncn1)N1CCC(CC1)c1nc(cn1CCN1CCCCC1)-c1ccc(F)c(c1)C(F)(F)F
CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1Br)-c1ccc(F)c(c1)C(F)(F)F
CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1ccc(F)cc1)-c1ccc(F)c(c1)C(F)(F)F
CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1ccncc1)-c1ccc(F)c(c1)C(F)(F)F
CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1ccc(N)nc1)-c1ccc(F)c(c1)C(F)(F)F
CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1cnc(N)nc1)-c1ccc(F)c(c1)C(F)(F)F
CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(C)=C)-c1ccc(F)c(c1)C(F)(F)F
CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C=C)-c1ccc(F)c(c1)C(F)(F)F
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(Cl)c2)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(OC(F)F)cc2)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)C2CCCCC2)c1C#N
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(Cl)c1
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)C1CCCCC1
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(OC(F)F)cc1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN(C)C)-c1ccc(F)c(c1)C(F)(F)F
CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1CCC1CC1)-c1ccc(F)c(c1)C(F)(F)F
CCOCCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN(C)C)-c1ccc(F)c(c1)C(F)(F)F
CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1\C=C\C1CC1)-c1ccc(F)c(c1)C(F)(F)F
CCO\C=C\c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN(C)C)-c1ccc(F)c(c1)C(F)(F)F
CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1ccc(cc1)C(C)(C)O)-c1ccc(F)c(c1)C(F)(F)F
COC(=O)c1ccc(cc1)-c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN(C)C)-c1ccc(F)c(c1)C(F)(F)F
CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1ccc(cc1)C(O)=O)-c1ccc(F)c(c1)C(F)(F)F
CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C1=CCCC1)-c1ccc(F)c(c1)C(F)(F)F |t:26|
CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C1CC1)-c1ccc(F)c(c1)C(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CC(F)C1)-c1ccc(F)c(c1)C(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CC(C)C1)-c1ccc(F)c(c1)C(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CC(F)(F)C1)-c1ccc(F)c(c1)C(F)(F)F
CCN(C)Cc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN(C)C)-c1ccc(F)c(c1)C(F)(F)F
CC(C)Oc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F
COc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1-c1cn[nH]c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1cncc(c1)C(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1cccc(OC(F)(F)F)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1cncc(Cl)c1
CCOc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1OCC(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccnc(Cl)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccnc(c1)C(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(N)=O
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(OC)c(c1)C(N)=O
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(OC)c1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1-c1cnoc1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1-c1cc[nH]c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccnc(C)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccnc(OC)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1cncc(C)c1
CC(C)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F
COc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccnc(c1)C(F)(F)F
CCOc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccnc(c1)C(F)(F)F
CC(C)Oc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccnc(c1)C(F)(F)F
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccnc(c2)C(F)(F)F)c1OCC(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1cccc(n1)C(F)(F)F
COc1cc(ccc1F)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C#N
COc1cc(ccc1F)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C(N)=O
Cc1cc(ccc1F)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C#N
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1cccc(Cl)n1
Cc1cc(ccc1F)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C(N)=O
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccnc(c2)C(F)(F)F)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccnc(c2)C(F)(F)F)c1Br
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCNCCCCl)-c2ccnc(c2)C(F)(F)F)c1Br
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccnc(c1)C(F)(F)F
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccoc2)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccsc2)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccccc2)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2cnoc2)c1C#N
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccoc1
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccsc1
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1cnoc1
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccccc1
Nc1ncnc(N2CCC(CC2)c2nc(cn2C2CCNC2)-c2ccc(F)c(c2)C(F)(F)F)c1C#N
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1C1CCNC1)-c1ccc(F)c(c1)C(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN)-c1ccc(F)c(c1)C(F)(F)F
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CC1CNC1)-c1ccc(F)c(c1)C(F)(F)F
Nc1ncnc(N2CCC(CC2)c2nc(cn2CC2CNC2)-c2ccc(F)c(c2)C(F)(F)F)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2C2CNC2)-c2ccc(F)c(c2)C(F)(F)F)c1C#N
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1C1CNC1)-c1ccc(F)c(c1)C(F)(F)F
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccnc(c2)C(F)(F)F)c1Cl
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1cn[nH]c1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CC2CCN2)-c2ccc(F)c(c2)C(F)(F)F)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CC2CCCN2)-c2ccc(F)c(c2)C(F)(F)F)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CC2CNC2)-c2ccc(F)c(c2)C(F)(F)F)c1Cl
Nc1ncnc(N2CCC(CC2)c2nc(cn2CC2CCN2)-c2ccc(F)c(c2)C(F)(F)F)c1Cl
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CC1CCN1)-c1ccc(F)c(c1)C(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CC1CNC1)-c1ccc(F)c(c1)C(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CC1CCN1)-c1ccc(F)c(c1)C(F)(F)F
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CC1CCCN1)-c1ccc(F)c(c1)C(F)(F)F
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1C1CCNCC1)-c1ccc(F)c(c1)C(F)(F)F
Nc1ncnc(N2CCC(CC2)c2nc(cn2C2CCNCC2)-c2ccc(F)c(c2)C(F)(F)F)c1C#N
CN1CC(Cn2cc(nc2C2CCN(CC2)c2ncnc(N)c2C(N)=O)-c2ccc(F)c(c2)C(F)(F)F)C1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1C1CCNCC1)-c1ccc(F)c(c1)C(F)(F)F
NCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(c1)C(F)(F)F
NCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(c1)C(F)(F)F
Cc1cc(ccc1F)-c1cn(CCO)c(n1)C1CCN(CC1)c1ncnc(N)c1-c1cn[nH]c1
Cc1cc(ccc1F)-c1cn(CCNC2CC2)c(n1)C1CCN(CC1)c1ncnc(N)c1-c1cn[nH]c1
CNCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1cn[nH]c1)-c1ccc(F)c(C)c1
CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1-c1cn[nH]c1)-c1ccc(F)c(C)c1
Cc1cc(ccc1F)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1-c1cn[nH]c1
Cc1cc(ccc1F)-c1cn(CCNC(C)(C)C)c(n1)C1CCN(CC1)c1ncnc(N)c1-c1cn[nH]c1
CNCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1Br)-c1ccnc(c1)C(F)(F)F
CNCCn1cc(nc1C1CCN(CC1)c1cc(N)ncn1)-c1ccnc(c1)C(F)(F)F
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccnc(c2)C(F)(F)F)c1-c1cnoc1
CNCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccnc(c1)C(F)(F)F
CNCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C1CON=C1)-c1ccnc(c1)C(F)(F)F |c:28|
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCNC)-c1ccnc(c1)C(F)(F)F
CNCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1Cl)-c1ccnc(c1)C(F)(F)F
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCNC2CC2)-c2ccnc(c2)C(F)(F)F)c1Cl
CCNCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1OC(C)C)-c1ccc(F)c(c1)C(F)(F)F
CC(C)Oc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CC1CNC1)-c1ccc(F)c(c1)C(F)(F)F
CCOc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CC1CNC1)-c1ccc(F)c(c1)C(F)(F)F
CCOc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(C)c1
CC(C)Oc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(C)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccnc(c1)C(C)C
CC(C)c1cc(ccn1)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1Cl
CC(C)c1cc(ccn1)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1Br
CC(C)c1cc(ccn1)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C=C
Nc1ncnc(N2CCC(CC2)c2nc(cn2CC2CNC2)-c2ccc(F)c(c2)C(F)(F)F)c1C=C
COc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CC1CNC1)-c1ccc(F)c(C)c1
CCOc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CC1CNC1)-c1ccc(F)c(C)c1
Cc1cc(ccc1F)-c1cn(CC2CNC2)c(n1)C1CCN(CC1)c1ncnc(N)c1OCC(F)(F)F
CC(C)Oc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CC1CNC1)-c1ccc(F)c(C)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CC1CNC1)-c1ccc(F)c(C)c1
CC(C)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CC1CNC1)-c1ccc(F)c(C)c1
Cc1cc(ccc1F)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1Br
Cc1cc(ccc1F)-c1cn(CC2CNC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C#N
CNc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccnc(c2)C(F)(F)F)c1Cl
CNc1ncnc(N2CCC(CC2)c2nc(cn2CC2CNC2)-c2ccc(F)c(C)c2)c1Cl
CC(C)c1c(N)ncnc1C1CCC(CC1)c1nc(cn1CC1CNC1)-c1ccc(F)c(C)c1 |(4.06,-5.67,;2.73,-4.9,;2.73,-3.36,;1.4,-5.67,;1.4,-7.21,;2.73,-7.98,;.06,-7.98,;-1.27,-7.21,;-1.27,-5.67,;.06,-4.9,;.06,-3.36,;1.4,-2.59,;1.4,-1.05,;.06,-.28,;-1.27,-1.05,;-1.27,-2.59,;.06,1.26,;-1.18,2.16,;-.71,3.63,;.83,3.63,;1.31,2.16,;2.64,1.39,;3.98,2.16,;5.46,1.76,;5.86,3.25,;4.37,3.65,;-1.8,4.72,;-1.4,6.2,;-2.49,7.29,;-3.98,6.89,;-5.06,7.98,;-4.37,5.41,;-5.86,5.01,;-3.28,4.32,)|
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCOCC1)-c1ccc(F)cc1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCOCC1)-c1ccc(F)c(F)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CC2(COC2)C1)-c1ccc(F)cc1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CC2(COC2)C1)-c1ccc(F)c(F)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CC(F)C1)-c1ccc(F)c(F)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CC(F)C1)-c1ccc(F)cc1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC2(COC2)C1)-c1ccc(F)cc1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC2(COC2)C1)-c1ccc(F)c(F)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC11COC1)-c1ccc(F)c(F)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC11COC1)-c1ccc(F)cc1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2cnc(F)c(Cl)c2)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccnc(F)c2)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc3[nH]ncc3c2)c1C#N
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(F)c(c1)C(F)(F)F
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1Cl
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(O)c(c2)C(F)(F)F)c1Cl
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1F
CC(=C)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCCC1)-c1ccc(F)c(c1)C(F)(F)F
CC(=C)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(F)c(c1)C(F)(F)F
Nc1cc(ncn1)N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(F)c(c1)C(F)(F)F
Cc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(F)c(c1)C(F)(F)F
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1Cl
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1Br
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1Cl
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1-c1ccc(F)cc1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1C=C
Nc1cc(ncn1)N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F
COC(=O)c1ccc(cc1)-c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F
COC(=O)c1ccc(cc1)-c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(F)c(c1)C(F)(F)F
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1-c1ccc(cc1)C(O)=O
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1-c1ccc(cc1)C(O)=O
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)c(F)c2)c1Br
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)cc2)c1Br
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2cccc(F)c2)c1Br
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(c(F)c2)C(F)(F)F)c1Br
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1cccc(F)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(F)cc1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(F)c(F)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(c(F)c1)C(F)(F)F
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(c(F)c2)C(F)(F)F)c1Cl
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2cccc(F)c2)c1Cl
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)cc2)c1Cl
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)c(F)c2)c1Cl
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(c(F)c2)C(F)(F)F)c1C=C
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2cccc(F)c2)c1C=C
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)cc2)c1C=C
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)c(F)c2)c1C=C
Nc1cc(ncn1)N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(F)c(F)c1
Nc1cc(ncn1)N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1cccc(F)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CC[C@H](F)C1)-c1ccc(c(F)c1)C(F)(F)F |r|
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CC[C@@H](F)C1)-c1ccc(c(F)c1)C(F)(F)F |r|
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC(F)(F)CC1)-c1ccc(c(F)c1)C(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC(F)(F)C1)-c1ccc(c(F)c1)C(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC(F)CC1)-c1ccc(c(F)c1)C(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC(F)C1)-c1ccc(c(F)c1)C(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(Cl)c(F)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(F)c(Cl)c1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCCC2)-c2ccc(c(F)c2)C(F)(F)F)c1C1CCC1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(c(F)c2)C(F)(F)F)c1C1CCC1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)c(F)c2)c1C1CCC1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)cc2)c1C1CCC1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2cccc(F)c2)c1C1CCC1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(cc2)C(F)(F)F)c1C1CCC1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(Cl)c(F)c2)c1C1CCC1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2cccc(c2)C(F)(F)F)c1C1CCC1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)c(Cl)c2)c1C1CCC1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(Cl)cc2)c1C1CCC1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2cccc(Cl)c2)c1C1CCC1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(cc2)C(F)(F)F)c1Br
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(Cl)c(F)c2)c1Br
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2cccc(c2)C(F)(F)F)c1Br
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)c(Cl)c2)c1Br
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(cc2)C(F)(F)F)c1C=C
Nc1cc(ncn1)N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(cc1)C(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(cc1)C(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1cccc(c1)C(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(Cl)cc1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1cccc(Cl)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC(F)(F)C1)-c1ccc(F)c(c1)C(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCCC1)-c1ccc(F)c(c1)C(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1cccc(c1)C(F)(F)F
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1cccc(F)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1cccc(Cl)c1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(c(F)c2)C(F)(F)F)c1C1CCC1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(Cl)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(F)c1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1[N+]([O-])=O
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1C=O
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1C(O)=O
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1C=O
CC(=O)Nc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F
CCOc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(F)c(Cl)c1
CC(C)Oc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(F)c(Cl)c1
CCOc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN(C)C)-c1ccc(F)c(c1)C(F)(F)F
CC(C)Oc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN(C)C)-c1ccc(F)c(c1)C(F)(F)F
CCOc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN(C)C)-c1ccc(F)c(C)c1
CC(C)Oc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN(C)C)-c1ccc(F)c(C)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN(C)C)-c1ccc(F)c(C)c1
CCN(CC)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1CC)-c1ccc(F)c(C)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(F)c(C)c1
CCOc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(F)c(C)c1
CC(C)Oc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(F)c(C)c1
CCN(CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1CC)-c1ccc(F)c(C)c1)C(C)C
CCOC1CN(CCC1c1nc(cn1CCN(CC)C(C)C)-c1ccc(F)c(C)c1)c1cc(N)ncn1
CCN(CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1OC(C)C)-c1ccc(F)c(C)c1)C(C)C
CCOc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN(CC)CC)-c1ccc(F)c(C)c1
CCN(CC)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1OC(C)C)-c1ccc(F)c(C)c1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)c(F)c2)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)c(Cl)c2)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2ccc(F)cc2)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2cccc(F)c2)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2cccc(c2)C(F)(F)F)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCC2)-c2cccc(Cl)c2)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(F)c2)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccc(OC(F)F)c(F)c2)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2cc[nH]c(=O)c2)c1C#N
Cc1ccc(cc1C(F)(F)F)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C#N
CC(C)c1cc(ccn1)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C#N
CCc1cc(ccn1)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccnc(c2)C2CC2)c1C#N
Cc1ccc(cc1F)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C#N
COc1ccc(cc1F)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C#N
Cc1ccc(cc1Cl)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C#N
COc1ccc(cc1Cl)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C#N
Cc1cc(ccc1F)-c1cn(CCN2CCCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C#N
CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(C)c1
CCN(CC)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(C)c1
CCN(CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(C)c1)C(C)C
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(F)c1
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(F)c(F)c1
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(F)c(Cl)c1
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(F)c(c1)C(F)(F)F
CC(C)c1cc(ccn1)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C(N)=O
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1ccc(F)cc1
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1cccc(F)c1
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1cccc(c1)C(F)(F)F
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCC1)-c1cccc(Cl)c1
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCCCC1)-c1ccc(F)c(c1)C(F)(F)F
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(OC(F)F)c1
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1cc[nH]c(=O)c1
Cc1ccc(cc1C(F)(F)F)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C(N)=O
CCc1cc(ccn1)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C(N)=O
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1ccnc(c1)C1CC1
CC(C)(C)c1cc(ccn1)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C(N)=O
Cc1ccc(cc1F)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C(N)=O
COc1ccc(cc1F)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C(N)=O
Cc1ccc(cc1Cl)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C(N)=O
COc1ccc(cc1Cl)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C(N)=O
CN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(C)c1
CCN(CC)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(C)c1
Cc1cc(ccc1F)-c1cn(CCN2CCCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C(N)=O
CCN(CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(C)c1)C(C)C
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCN1CCC1)-c1cnc(nc1)N(C)C
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2ccccc2F)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2cccc(c2)S(N)(=O)=O)c1C#N
CS(=O)(=O)c1cccc(c1)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C#N
CS(=O)(=O)c1cccc(c1)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C(N)=O
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCO)-c2ccc(F)c(c2)C(F)(F)F)c1C#N
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCNCC2CC2)-c2ccc(F)c(c2)C(F)(F)F)c1C#N
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCNCC1CC1)-c1ccc(F)c(c1)C(F)(F)F
CC(C)N(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(c1)C(F)(F)F
CC(C)N(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(c1)C(F)(F)F
CN(C)CCN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(c1)C(F)(F)F
COCCN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(c1)C(F)(F)F
COCCNCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(c1)C(F)(F)F
CN(C)CCN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(c1)C(F)(F)F
COCCN(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(c1)C(F)(F)F
COCCNCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(c1)C(F)(F)F
CN(CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(c1)C(F)(F)F)Cc1ccccc1
CC(C)NCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(c1)C(F)(F)F
CC(C)NCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(c1)C(F)(F)F
COCC(C)NCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(c1)C(F)(F)F
CC(C)CNCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(c1)C(F)(F)F
CC(C)CNCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(c1)C(F)(F)F
CNCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(c1)C(F)(F)F
CC(C)(C)NCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(c1)C(F)(F)F
CNCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(c1)C(F)(F)F
CC(C)(C)NCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(c1)C(F)(F)F
Cc1cc(ccc1F)-c1cn(CCNCC2CC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C#N
CC(C)N(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(C)c1
CC(C)NCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(C)c1
Nc1ncnc(N2CCC(CC2)c2nc(cn2CCNC2CCCC2)-c2ccc(F)c(c2)C(F)(F)F)c1C#N
CCC(C)(C)NCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(c1)C(F)(F)F
Cc1cc(ccc1F)-c1cn(CCNCC2CC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C(N)=O
Cc1cc(ccc1F)-c1cn(CCO)c(n1)C1CCN(CC1)c1ncnc(N)c1C#N
CC(C)N(C)CCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(C)c1
CC(C)NCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(C)c1
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCNC1CCCC1)-c1ccc(F)c(c1)C(F)(F)F
CCC(C)(C)NCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(c1)C(F)(F)F
Cc1cc(ccc1F)-c1cn(CCNC2CCCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C#N
CC(C)CNCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(C)c1
Cc1cc(ccc1F)-c1cn(CCNC2CCCC2)c(n1)C1CCN(CC1)c1ncnc(N)c1C(N)=O
CC(C)CNCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(C)c1
Cc1cc(ccc1F)-c1cn(CCO)c(n1)C1CCN(CC1)c1ncnc(N)c1C(N)=O
CNCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C#N)-c1ccc(F)c(C)c1
NC(=O)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCO)-c1ccc(F)c(c1)C(F)(F)F
CCOc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCO)-c1ccc(F)c(C)c1
CNCCn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(C)c1
CCOc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CCNC(C)C)-c1ccc(F)c(c1)C(F)(F)F
CC(C)c1c(N)ncnc1N1CCC(CC1)c1nc(cn1CC1CN(CO)C1)-c1ccc(F)c(C)c1
CCc1c(N)ncnc1N1CCC(CC1)c1nc(cn1CC1CN(C)C1)-c1ccc(F)c(C)c1
FC(F)C1CN(C1)c1cnc(cc1-n1cnc(c1)C1CC1)C(=O)Nc1csc(n1)-c1nncn1C1CC1
O=C(Nc1csc(n1)-c1nncn1C1CC1)c1cc(c(cn1)N1CC(C1)C#N)-n1cnc(c1)C1CC1
CC1(CN(C1)c1cnc(cc1-n1cnc(c1)C1CC1)C(=O)Nc1csc(n1)-c1nncn1C1CC1)C#N
COC1(C)CN(C1)c1cnc(cc1-n1cnc(c1)C1CC1)C(=O)Nc1csc(n1)-c1nncn1C1CC1
FC1(F)CN(C1)c1cnc(cc1-n1cnc(c1)C1CC1)C(=O)Nc1csc(n1)-c1nncn1C1CC1
COC1CCN(C1)c1cnc(cc1-n1cnc(c1)C1CC1)C(=O)Nc1csc(n1)-c1nncn1C1CC1
FC(F)(F)C1CCN(CC1)c1cnc(cc1-n1cnc(c1)C1CC1)C(=O)Nc1csc(n1)-c1nncn1C1CC1
FC1CCN(CC1)c1cnc(cc1-n1cnc(c1)C1CC1)C(=O)Nc1csc(n1)-c1nncn1C1CC1
O=C(Nc1csc(n1)-c1nncn1C1CC1)c1cc(c(cn1)N1CCC(CC1)C#N)-n1cnc(c1)C1CC1
COC1CCN(CC1)c1cnc(cc1-n1cnc(c1)C1CC1)C(=O)Nc1csc(n1)-c1nncn1C1CC1
CNC(=O)C1CCN(CC1)c1cnc(cc1-n1cnc(c1)C1CC1)C(=O)Nc1csc(n1)-c1nncn1C1CC1
COC1(C)CCN(CC1)c1cnc(cc1-n1cnc(c1)C1CC1)C(=O)Nc1csc(n1)-c1nncn1C1CC1
FC(F)(F)CN1CCN(CC1)c1cnc(cc1-n1cnc(c1)C1CC1)C(=O)Nc1csc(n1)-c1nncn1C1CC1
O=C(Nc1csc(n1)-c1nncn1C1CC1)c1cc(c(cn1)N1CCCOCC1)-n1cnc(c1)C1CC1
O=C(Nc1csc(n1)-c1nncn1C1CC1)c1cc(c(cn1)N1CCN2CCCC2C1)-n1cnc(c1)C1CC1
O=C(Nc1csc(n1)-c1nncn1C1CC1)c1cc(c(cn1)N1CCN2C(COC2=O)C1)-n1cnc(c1)C1CC1
O=C(Nc1csc(n1)-c1nncn1C1CC1)c1cc(c(cn1)N1CC2CC2C1)-n1cnc(c1)C1CC1
O=C(Nc1csc(n1)-c1nncn1C1CC1)c1cc(c(cn1)N1CC(C1)N1CCOCC1)-n1cnc(c1)C1CC1
O=C(Nc1csc(n1)-c1nncn1C1CC1)c1cc(c(cn1)N1CCN(CC1)C1CC1)-n1cnc(c1)C1CC1
O=C(Nc1csc(n1)-c1nncn1C1CC1)c1cc(c(cn1)N1CCN(CC2CC2)CC1)-n1cnc(c1)C1CC1
O=C(Nc1csc(n1)-c1nncn1C1CC1)c1cc(c(cn1)N1CCC2(COC2)CC1)-n1cnc(c1)C1CC1
O=C(Nc1csc(n1)-c1nncn1C1CC1)c1cc(c(cn1)N1CC2(C1)CCOCC2)-n1cnc(c1)C1CC1
COCC1CN(C1)c1cnc(cc1-n1cnc(c1)C1CC1)C(=O)Nc1csc(n1)-c1nncn1[C@@H](C)C(F)(F)F |r|
C[C@H](n1cnnc1-c1nc(NC(=O)c2cc(c(cn2)N2CC(C)(C2)C#N)-n2cnc(c2)C2CC2)cs1)C(F)(F)F |r|
COC1(C)CN(C1)c1cnc(cc1-n1cnc(c1)C1CC1)C(=O)Nc1csc(n1)-c1nncn1[C@@H](C)C(F)(F)F |r|
C[C@H](n1cnnc1-c1nc(NC(=O)c2cc(c(cn2)N2CC(C2)C(F)F)-n2cnc(c2)C2CC2)cs1)C(F)(F)F |r|
C[C@H](n1cnnc1-c1nc(NC(=O)c2cc(c(cn2)N2CCC(F)(F)C2)-n2cnc(c2)C2CC2)cs1)C(F)(F)F |r|
COC1CCN(C1)c1cnc(cc1-n1cnc(c1)C1CC1)C(=O)Nc1csc(n1)-c1nncn1[C@@H](C)C(F)(F)F |r|
C[C@H](n1cnnc1-c1nc(NC(=O)c2cc(c(cn2)N2CCC(CC2)C#N)-n2cnc(c2)C2CC2)cs1)C(F)(F)F |r|
COC1CCN(CC1)c1cnc(cc1-n1cnc(c1)C1CC1)C(=O)Nc1csc(n1)-c1nncn1[C@@H](C)C(F)(F)F |r|
CNC(=O)C1CCN(CC1)c1cnc(cc1-n1cnc(c1)C1CC1)C(=O)Nc1csc(n1)-c1nncn1[C@@H](C)C(F)(F)F |r|
C[C@H](n1cnnc1-c1nc(NC(=O)c2cc(c(cn2)N2CCC(CC2)C(F)(F)F)-n2cnc(c2)C2CC2)cs1)C(F)(F)F |r|
C[C@H](n1cnnc1-c1nc(NC(=O)c2cc(c(cn2)N2CCN(CC(F)(F)F)CC2)-n2cnc(c2)C2CC2)cs1)C(F)(F)F |r|
C[C@H](n1cnnc1-c1nc(NC(=O)c2cc(c(cn2)N2CCC(F)CC2)-n2cnc(c2)C2CC2)cs1)C(F)(F)F |r|
COC1(C)CCN(CC1)c1cnc(cc1-n1cnc(c1)C1CC1)C(=O)Nc1csc(n1)-c1nncn1[C@@H](C)C(F)(F)F |r|
C[C@H](n1cnnc1-c1nc(NC(=O)c2cc(c(cn2)N2CCCOCC2)-n2cnc(c2)C2CC2)cs1)C(F)(F)F |r|
C[C@H](n1cnnc1-c1nc(NC(=O)c2cc(c(cn2)N2CCN3CCCC3C2)-n2cnc(c2)C2CC2)cs1)C(F)(F)F |r|
C[C@H](n1cnnc1-c1nc(NC(=O)c2cc(c(cn2)N2CC3CN(C)CC3C2)-n2cnc(c2)C2CC2)cs1)C(F)(F)F |r|
C[C@H](n1cnnc1-c1nc(NC(=O)c2cc(c(cn2)N2CCN3C(COC3=O)C2)-n2cnc(c2)C2CC2)cs1)C(F)(F)F |r|
C[C@H](n1cnnc1-c1nc(NC(=O)c2cc(c(cn2)N2CC3CC3C2)-n2cnc(c2)C2CC2)cs1)C(F)(F)F |r|
C[C@H](n1cnnc1-c1nc(NC(=O)c2cc(c(cn2)N2CC(C2)N2CCOCC2)-n2cnc(c2)C2CC2)cs1)C(F)(F)F |r|
C[C@H](n1cnnc1-c1nc(NC(=O)c2cc(c(cn2)N2CCN(CC2)C2CC2)-n2cnc(c2)C2CC2)cs1)C(F)(F)F |r|
C[C@H](n1cnnc1-c1nc(NC(=O)c2cc(c(cn2)N2CCN(CC3CC3)CC2)-n2cnc(c2)C2CC2)cs1)C(F)(F)F |r|
C[C@H](n1cnnc1-c1nc(NC(=O)c2cc(c(cn2)N2CCC3(COC3)CC2)-n2cnc(c2)C2CC2)cs1)C(F)(F)F |r|
C[C@H](n1cnnc1-c1nc(NC(=O)c2cc(c(cn2)N2CC3(C2)CCOCC3)-n2cnc(c2)C2CC2)cs1)C(F)(F)F |r|
NC1(CCC1)c1ccc(cc1)-c1nc2c(O)nccn2c1-c1ccccc1
Cc1cn2c(c(nc2c(C)n1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
COc1nc(Br)cn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
CCc1cn2c(c(nc2c(OC)n1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
CCOC(=O)c1cn2c(c(nc2cn1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC(=O)c1cn2c(c(nc2cn1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
COC(=O)c1cn2c(c(nc2c(OC)n1)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
COc1nc(cn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1)C(N)=O
Nc1ccc(cn1)-c1ccc2ncc3c(n(-c4cccc(c4)C(F)(F)F)c(=O)[nH]c3=O)c2n1
CC(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1
C[C@H](NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1 |r|
CCC(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1
CC[C@H](NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1 |r|
CC[C@@H](NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1 |r|
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NC(C1CC1)c1ccc(Cl)cc1
NCC(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1
C[C@H](NC(=O)C1(CN)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1 |r|
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NC(CCCO)c1ccc(Cl)cc1
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)N[C@@H](CCCO)c1ccc(Cl)cc1 |r|
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)N[C@H](CCCO)c1ccc(Cl)cc1 |r|
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NC(CO)c1ccc(Cl)cc1
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)N[C@H](CCO)c1ccc(Cl)cc1 |r|
CC(=O)NCCC(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1
CN(C)CCC(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1
CN(C)CC[C@H](NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1 |r|
CN(C)CC[C@@H](NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1 |r|
NCC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NC(CCO)c1ccc(Cl)cc1
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NC(CCO)c1ccc(Cl)cc1
NCCC(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1
C[C@@H](NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1 |r|
C[C@@H](NC(=O)C1(CN)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1 |r|
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)N[C@@H](CCO)c1ccc(cc1)C#N |r|
NC1(CCN(CC1)c1ncnc2[nH]cc(Br)c12)C(=O)N[C@@H](CCO)c1ccc(Cl)cc1 |r|
NC1(CCN(CC1)c1ncnc2[nH]ncc12)C(=O)N[C@@H](CCO)c1ccc(Cl)cc1 |r|
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)N[C@@H](CCO)c1ccccc1 |r|
NC1(CCN(CC1)c1ncnc2[nH]cnc12)C(=O)N[C@@H](CCO)c1ccc(Cl)cc1 |r|
NCC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)N[C@@H](CCO)c1ccc(Cl)cc1 |r|
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)N[C@@H](CCO)c1ccc(Br)cc1 |r|
CN(C)CCCC(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1
CCN(CC)CC[C@H](NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1 |r|
NC1(CCN(CC1)c1ncnc2[nH]cc(C3CC3)c12)C(=O)N[C@@H](CCO)c1ccc(Cl)cc1 |r|
CNCCC(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NC(c1ccccc1)c1ccc(Cl)cc1
NC(=O)C(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1
C[C@H](NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]nc(Br)c12)c1ccc(Cl)cc1 |r|
C[C@H](NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]cc(Cl)c12)c1ccc(Cl)cc1 |r|
NC1(CCN(CC1)c1ncnc2[nH]nc(Br)c12)C(=O)N[C@@H](CCO)c1ccc(Cl)cc1 |r|
NC1(CCN(CC1)c1ncnc2[nH]cc(Cl)c12)C(=O)N[C@@H](CCO)c1ccc(Cl)cc1 |r|
C[C@H](NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]cc(Br)c12)c1ccc(Cl)cc1 |r|
Cc1c[nH]c2ncnc(N3CCC(N)(CC3)C(=O)N[C@@H](CCO)c3ccc(Cl)cc3)c12 |r|
C[C@H](NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]cc(C)c12)c1ccc(Cl)cc1 |r|
CC(C)(O)C[C@H](NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1 |r|
C[C@H](NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(cc1)C#N |r|
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)N[C@@H](CCO)c1cccc(Cl)c1 |r|
C[C@H](NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(cc1)C(F)(F)F |r|
C[C@@H](NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Br)cc1 |r|
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NC(Cc1ccccc1)c1ccc(Cl)cc1
CC(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(F)cc1
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NC(C#N)c1ccc(Cl)cc1
CC(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccccc1
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NC(CCCN1CCCC1)c1ccc(Cl)cc1
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NC(CCCN1CCOCC1)c1ccc(Cl)cc1
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NC(CCCN1CCCCC1)c1ccc(Cl)cc1
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)N[C@H](CCCN1CCCCC1)c1ccc(Cl)cc1 |r|
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)N[C@@H](CCCN1CCCCC1)c1ccc(Cl)cc1 |r|
CN1CCN(CC[C@H](NC(=O)C2(N)CCN(CC2)c2ncnc3[nH]ccc23)c2ccc(Cl)cc2)CC1 |r|
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)N[C@@H](CCN1CCOCC1)c1ccc(Cl)cc1 |r|
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)N[C@@H](CCN1CCCCC1)c1ccc(Cl)cc1 |r|
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)N[C@@H](CCN1CCNCC1)c1ccc(Cl)cc1 |r|
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)N[C@@H](CCn1ccnc1)c1ccc(Cl)cc1 |r|
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)N[C@@H](CCN1CCCC1)c1ccc(Cl)cc1 |r|
CS(=O)(=O)NCC(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NC(CS(N)(=O)=O)c1ccc(Cl)cc1
CC(=O)NCC(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NC(Cc1ncc[nH]1)c1ccc(Cl)cc1
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NC(Cn1cccn1)c1ccc(Cl)cc1
Cc1cc(CC(NC(=O)C2(N)CCN(CC2)c2ncnc3[nH]ccc23)c2ccc(Cl)cc2)on1
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NC(Cc1nccs1)c1ccc(Cl)cc1
CN(C)C(=O)CC(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1
COCCC(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NC(CCS(N)(=O)=O)c1ccc(Cl)cc1
NC(=O)CC(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1
NC(=O)NCCC(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NC(CC#N)c1ccc(Cl)cc1
CS(=O)(=O)NCCC(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1
CC(N)c1ccc(Oc2ccc3COB(O)c3c2)c(F)c1
Cc1c2B(O)OCc2ccc1Oc1ccc(CN)cc1F
CC(N)c1ccc(Oc2ccc3COB(O)c3c2C)c(F)c1
C[C@H](N)c1ccc(Oc2ccc3COB(O)c3c2C)c(F)c1 |r|
C[C@@H](N)c1ccc(Oc2ccc3COB(O)c3c2C)c(F)c1 |r|
Cc1c2B(O)OCc2ccc1Oc1cccc(CNC(=O)OC(C)(C)C)c1F
Cc1c2B(O)OCc2ccc1Oc1cccc(CN)c1F
CC(C)c1c2B(O)OCc2ccc1Oc1ccc(CN)cc1Cl
Cc1ccc2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
CCc1ccc2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(nn2c1-c1ccccc1)C(F)(F)F
CCOC(=O)c1ccc2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
NC(=O)c1ccc2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
COc1ccc2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
COc1cc(Br)nn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(nn2c1-c1ccccc1)C(O)=O
COc1cc(OC)c2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
COc1cc(nn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1)C(C)=O
COc1ccnn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
COC(=O)c1cc(OC)c2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
CCc1cc(OC)c2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
COc1cc(-c2cccnc2)c2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
COc1cc(-c2cn[nH]c2)c2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
CCc1cc(CC)c2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(Cl)nn2c1-c1ccccc1
COc1cc(C=C)nn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c(cc(Cl)nn2c1-c1ccccc1)-c1cc[nH]n1
NC1(CCC1)c1ccc(cc1)-c1nc2c(cc(C=C)nn2c1-c1ccccc1)-c1cc[nH]n1
CCc1cc(-c2cc[nH]n2)c2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
CCOc1cc(nn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1)C(=O)NC
Cn1nccc1-c1cc(Cl)nn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c(cc(Cl)nn2c1-c1ccccc1)-c1ncc[nH]1
NC1(CCC1)c1ccc(cc1)-c1nc2cccnn2c1-c1ccccc1
CNC(=O)c1cc(OC)c2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2c(ccnn2c1-c1ccccc1)-c1cc[nH]n1
COCCOc1cc(nn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1)C(N)=O
NC1(CCC1)c1ccc(cc1)-c1nc2c(OCc3ccccc3)cc(Cl)nn2c1-c1ccccc1
CCOc1cc(Cl)nn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
COC(=O)c1ccnn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c(O)ccnn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(nn2c1-c1ccccc1)-c1ccc(F)cc1
NC(=O)c1cc(C(N)=O)c2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
Nc1ccc2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
CSc1ccc2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
CC(=O)Nc1ccc2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
CS(=O)(=O)c1ccc2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
COC(=O)c1ccc2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(NC(=O)C(F)(F)F)nn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(Br)nn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2c(cc(nn2c1-c1ccccc1)-c1ccc(F)cc1)-c1ccc(F)cc1
CC(=O)c1ccc2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2c(ccnn2c1-c1ccccc1)-c1ccc(F)cc1
CS(=O)(=O)Nc1ccc2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2c(cc(Cl)nn2c1-c1ccccc1)C1CC1
CCCc1ccnn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
Nc1ccnn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
CC(=O)Nc1ccnn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
Cc1c(Cl)nn2c(c(nc2c1C)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
COC(=O)c1nn2c(c(nc2c(C)c1C)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
Cc1c(C)c2nc(c(-c3ccccc3)n2nc1C(N)=O)-c1ccc(cc1)C1(N)CCC1
COc1nn2c(c(nc2c(C)c1C)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
CSc1nn2c(c(nc2c(C)c1C)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
CCOc1nn2c(c(nc2c(C)c1C)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
COC(=O)c1cc(-c2cc[nH]n2)c2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
CCOc1cc(nn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1)C(=O)OC
COC(=O)c1cc(-c2ncc[nH]2)c2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
NC(=O)c1ccnn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
NC(=O)c1cc(-c2cc[nH]n2)c2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
CCOc1cc(nn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1)C(N)=O
CNC(=O)c1cc(-c2ncc[nH]2)c2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
CNC(=O)c1ccnn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
CNC(=O)c1cc(OCC2CC2)c2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
CNC(=O)c1cc(-c2cc[nH]n2)c2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
CCNC(=O)c1ccc2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2c(cc(nn2c1-c1ccccc1)C(O)=O)-c1cc[nH]n1
CNC(=O)c1ccc2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
CN(C)C(=O)c1ccc2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(nn2c1-c1ccccc1)C(=O)NCCO
NC1(CCC1)c1ccc(cc1)-c1nc2c(cc(nn2c1-c1ccccc1)C(=O)NCCO)-c1cc[nH]n1
COC(=O)\C=C\c1cc(Br)nn2c(c(nc12)-c1ccc(cc1)C1(CCC1)NC(=O)OC(C)(C)C)-c1ccccc1
COc1cc(-c2cc[nH]n2)c2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
COc1cc(-c2ccnn2C)c2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
COc1cc(-c2ccncc2)c2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
CCOc1cc(OCC)c2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
CCCCOc1cc(OCC)nn2c(c(nc12)-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
CCOc1ccc2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
NC1(CCC1)c1ccc(cc1)-c1nc2ccc(O)nn2c1-c1ccccc1
COC(=O)COc1ccc2nc(c(-c3ccccc3)n2n1)-c1ccc(cc1)C1(N)CCC1
Nc1ncnc(N2CC[C@H]([C@@H](F)C2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1C#N |r|
NC(=O)c1c(N)ncnc1N1CC[C@H]([C@@H](F)C1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F |r|
NC(=O)c1c(N)ncnc1N1CC[C@H]([C@@H](F)C1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F
NC(=O)c1c(N)ncnc1N1CC[C@@H]([C@H](F)C1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F
C[C@H]1CN(CC[C@H]1c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F)c1ncnc(N)c1C#N |r|
C[C@H]1CN(CC[C@H]1c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F)c1ncnc(N)c1C(N)=O |r|
Nc1ncnc(N2CC[C@@H]([C@@H](F)C2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1C#N |r|
NC(=O)c1c(N)ncnc1N1CC[C@H]([C@H](F)C1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F |r|
CN(C)CCn1cc(nc1[C@@H]1CCN(C[C@@H]1F)c1ncnc(N)c1C#N)-c1ccc(F)c(C)c1 |r|
Nc1ncnc(N2CC[C@H]([C@@H](F)C2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1Cl |r|
Nc1ncnc(N2CC[C@H]([C@H](F)C2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1Cl |r|
CN(C)CCn1cc(nc1[C@H]1CCN(C[C@H]1F)c1ncnc(N)c1Cl)-c1ccc(F)c(C)c1 |r|
CCc1c(N)ncnc1N1CC[C@H]([C@@H](F)C1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F |r|
CN(C)CCn1cc(nc1[C@@H]1CCN(C[C@@H]1F)c1ncnc(N)c1C#N)-c1ccc(F)c(c1)C(F)(F)F |r|
CN(C)CCn1cc(nc1[C@@H]1CCN(C[C@@H]1F)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(c1)C(F)(F)F |r|
CCOc1c(N)ncnc1N1CC[C@H]([C@@H](F)C1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F |r|
CC(C)c1c(N)ncnc1N1CC[C@H]([C@@H](F)C1)c1nc(cn1CCN(C)C)-c1ccc(F)c(c1)C(F)(F)F
Cc1cc(ccc1F)-c1cn(CCN2CCC2)c(n1)[C@@H]1CCN(C[C@@H]1F)c1ncnc(N)c1C#N
Cc1cc(ccc1F)-c1cn(CCN2CCC2)c(n1)[C@@H]1CCN(C[C@@H]1F)c1ncnc(N)c1C(N)=O
CN(C)CCn1cc(nc1[C@H]1CCN(C[C@H]1F)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(c1)C(F)(F)F
CN(C)CCn1cc(nc1[C@@H]1CCN(C[C@@H]1F)c1ncnc(N)c1C(N)=O)-c1ccc(F)c(c1)C(F)(F)F
CCOc1c(N)ncnc1N1CC[C@H]([C@@H](F)C1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F
CCOc1c(N)ncnc1N1CC[C@@H]([C@H](F)C1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F
CC(C)c1c(N)ncnc1N1CC[C@H]([C@@H](F)C1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(C)c1
CN(C)CCn1cc(nc1[C@@H]1CCN(C[C@@H]1F)c1ncnc(N)c1Cl)-c1ccc(F)c(c1)C(F)(F)F |r|
CC(C)c1c(N)ncnc1N1CC[C@H]([C@@H](F)C1)c1nc(c[nH]1)-c1ccc(F)c(c1)C(F)(F)F
Cc1cc(ccc1F)-c1cn(CCN2CCC2)c(n1)[C@H]1CCN(C[C@H]1F)c1ncnc(N)c1C(N)=O
CN(C)CCn1cc(nc1[C@@H]1CCN(C[C@@H]1F)c1ncnc(N)c1Cl)-c1ccc(F)c(c1)C(F)(F)F
CN(C)CCn1cc(nc1[C@H]1CCN(C[C@H]1F)c1ncnc(N)c1Cl)-c1ccc(F)c(c1)C(F)(F)F
CC(C)c1c(N)ncnc1N1CC[C@@H]([C@H](F)C1)c1nc(cn1CCN(C)C)-c1ccc(F)c(c1)C(F)(F)F
CC(C)c1c(N)ncnc1N1CC[C@H]([C@@H](F)C1)c1nc(cn1CCN)-c1ccc(F)c(c1)C(F)(F)F
CC(C)c1c(N)ncnc1N1CC[C@@H]([C@H](F)C1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(C)c1
NCCn1cc(nc1[C@@H]1CCN(C[C@@H]1F)c1ncnc(N)c1Cl)-c1ccc(F)c(c1)C(F)(F)F |r|
CC(C)NCCn1cc(nc1[C@@H]1CCN(C[C@@H]1F)c1ncnc(N)c1C(C)C)-c1ccc(F)c(C)c1
CNCCn1cc(nc1[C@@H]1CCN(C[C@@H]1F)c1ncnc(N)c1C(C)C)-c1ccc(F)c(C)c1
CC(C)Oc1c(N)ncnc1N1CC[C@H]([C@@H](F)C1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(C)c1
Nc1ncnc(N2CC[C@H]([C@@H](F)C2)c2nc(cn2CCN2CCC2)-c2ccc(F)c(c2)C(F)(F)F)c1C#N
CC(C)c1c(N)ncnc1N1CC[C@H]([C@@H](F)C1)c1nc(cn1CC1CNC1)-c1ccc(F)c(C)c1
F[C@H]1CN(CC[C@H]1c1nc(cn1CCN1CCC1)-c1ccc(F)c(c1)C(F)(F)F)c1ncnc2[nH]cc(C#N)c12 |r|
F[C@H]1CN(CC[C@H]1c1nc(cn1CCN1CCC1)-c1ccnc(c1)C(F)(F)F)c1ncnc2[nH]cc(C#N)c12 |r|
Cc1cc(ccc1F)-c1cn(CCN2CCC2)c(n1)C1(O)CCN(CC1)c1ncnc(N)c1C#N
CC(C)c1c(N)ncnc1N1CCC(O)(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(C)c1
CCc1c(N)ncnc1N1CCC(O)(CC1)c1nc(cn1CCN1CCC1)-c1ccc(F)c(C)c1
Cc1cc(ccc1F)-c1cn(CCN2CCC2)c(n1)C1(O)CCN(CC1)c1ncnc(N)c1Cl
Cc1cc(ccc1F)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1(F)F)c1ncnc(N)c1C#N
Cc1cc(ccc1F)-c1cn(CCN2CCC2)c(n1)C1CCN(CC1(F)F)c1ncnc(N)c1C(N)=O
CC(C)c1c(N)ncnc1N1CCC(c2nc(cn2CCN2CCC2)-c2ccc(F)c(C)c2)C(F)(F)C1
NC(=O)c1cccc2c(NCc3cccc(c3)C(F)(F)F)nnnc12
NC(=O)c1cccc2c(NCc3ccc(Cl)c(Cl)c3)nnnc12
NC(=O)c1cccc2c(NCc3cccnc3)nnnc12
NC(=O)c1cccc2c(NCc3ccc(Cl)c(c3)C(F)(F)F)nnnc12
NC(=O)c1cccc2c(NCc3ccccn3)nnnc12
NC(=O)c1cccc2c(NCc3ccccc3)nnnc12
NC(=O)c1cccc2c(NCc3ccc(cn3)C(F)(F)F)nnnc12
NC(=O)c1cccc2c(NCc3ccc(cc3)C(F)(F)F)nnnc12
NC(=O)c1cccc2c(NCc3cccc(F)c3)nnnc12
COc1cc(ccc1Cl)[C@@H](CN1CCC1)Nc1nnnc2c(cccc12)C(N)=O |r|
COc1cc(ccc1Cl)[C@@H](CN(C)C)Nc1nnnc2c(cccc12)C(N)=O |r|
NC(=O)c1cccc2c(N[C@H](CN3CCC3)c3ccc(F)c(c3)C(F)(F)F)nnnc12 |r|
CN(C)C[C@@H](Nc1nnnc2c(cccc12)C(N)=O)c1ccc(Cl)c(c1)C(F)(F)F |r|
NC(=O)c1cccc2c(N[C@H](CN3CCC3)c3ccc(Cl)c(c3)C(F)(F)F)nnnc12 |r|
CN(C)C[C@@H](Nc1nnnc2c(cccc12)C(N)=O)c1ccc(Cl)c(Cl)c1 |r|
NC(=O)c1cccc2c(N[C@H](CN3CCC3)c3ccc(Cl)c(Cl)c3)nnnc12 |r|
CN(C)C[C@@H](Nc1nnnc2c(cccc12)C(N)=O)c1ccc(Cl)c(c1)C#N |r|
NC(=O)c1cccc2c(N[C@H](CN3CCC3)c3ccc(Cl)c(c3)C#N)nnnc12 |r|
NC(=O)c1cncc2c(N[C@@H](CN3CCC3)c3ccc(Cl)c(c3)C(F)(F)F)ncnc12 |r|
NC(=O)c1cncc2c(N[C@H](CN3CCC3)c3ccc(Cl)c(c3)C(F)(F)F)ncnc12 |r|
NC(=O)c1cccc2c(NC3CNCCC3c3cccc(c3)C(F)(F)F)nnnc12
NC(=O)c1cccc2c(NC3CNCCC3c3ccc(cc3)C(F)(F)F)nnnc12
NC(=O)c1ccnc2c(NC3CNCCC3c3ccc(F)c(Cl)c3)ncnc12
NC(=O)c1ccnc2c(NC3CNCCC3c3ccc(cc3)C(F)(F)F)ncnc12
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(c(F)c1)C(F)(F)F |r|
NC(=O)c1ccnc2c(N[C@H](CN3CCC3)c3ccc(cc3)C(F)(F)F)ncnc12 |r|
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(F)c(Br)c1 |r|
CCNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(c(F)c1)C(F)(F)F |r|
CCNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(F)c(Br)c1 |r|
CCNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1cc(F)c(OC)cc1F |r|
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1cc(F)c(OC)cc1F |r|
CCNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(Cl)c(c1)C(F)(F)F |r|
CCNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1cc(F)cc(c1)C(F)(F)F |r|
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1cc(F)cc(c1)C(F)(F)F |r|
NC(=O)c1ccnc2c(N[C@H](CN3CCC3)c3ccc(Cl)cc3)ncnc12 |r|
CC(C)c1ccc(cc1)[C@@H](CN1CCC1)Nc1ncnc2c(ccnc12)C(N)=O |r|
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(cc1)C(F)(F)F |r|
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(cc1)C(C)C |r|
CNC[C@@H](Nc1ncnc2c(nccc12)C(N)=O)c1ccc(cc1)C(C)C |r|
NC(=O)c1ccnc2c(N[C@H](CN3CCC3)c3ccc(Cl)c(c3)C(F)(F)F)ncnc12 |r|
CNC[C@@H](Nc1ncnc2c(nccc12)C(N)=O)c1ccc(Cl)c(c1)C(F)(F)F |r|
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(c(c1)C(F)(F)F)C(F)(F)F |r|
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(Cl)c(C)c1 |r|
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(Cl)cc1 |r|
Cc1cc(ccc1Cl)[C@@H](CN1CCC1)Nc1ncnc2c(ccnc12)C(N)=O |r|
NC(=O)c1ccnc2c(N[C@H](CN3CCC3)c3ccc(C#N)c(Cl)c3)ncnc12 |r|
NC(=O)c1ccnc2c(N[C@H](CN3CCC3)c3ccc(F)c(c3)C(F)F)ncnc12 |r|
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(F)c(c1)C(F)(F)F |r|
CN(C)C[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(F)c(c1)C(F)(F)F |r|
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(F)c(c1)C(F)F |r|
CC(C)NC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(F)c(c1)C(F)(F)F |r|
CN(C)C[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(Cl)c(F)c1 |r|
CC(C)NC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(Cl)c(F)c1 |r|
CC(C)NC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(Cl)c(c1)C(F)(F)F |r|
CCNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(F)c(c1)C(F)(F)F |r|
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(F)c(Cl)c1 |r|
CCNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1cc(F)c(F)cc1F |r|
CCNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(c(c1)C(F)(F)F)C(F)(F)F |r|
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1cc(F)c(F)cc1F |r|
CCNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(F)c(Cl)c1 |r|
NC(=O)c1ccnc2c(N[C@H](CN3CCC3)c3ccc(F)c(c3)C(F)(F)F)ncnc12 |r|
NC(=O)c1ccnc2c(N[C@H](CN3CCC3)c3ccc(c(c3)C(F)(F)F)C(F)(F)F)ncnc12 |r|
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1cccc(Cl)c1 |r|
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1cccc(Br)c1 |r|
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1cccc(F)c1 |r|
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(F)c(C)c1 |r|
NC(=O)c1ccnc2c(N[C@H](CN3CCC3)c3cccc(F)c3)ncnc12 |r|
NC(=O)c1ccnc2c(N[C@H](CN3CC(F)C3)c3ccc(Cl)c(c3)C(F)(F)F)ncnc12 |r|
NC(=O)c1ccnc2c(N[C@H](CN3CC(O)C3)c3ccc(Cl)c(c3)C(F)(F)F)ncnc12 |r|
NC(=O)c1ccnc2c(N[C@@H](CN3CCC3)c3ccc(Cl)c(c3)C(F)(F)F)ncnc12 |r|
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(Cl)c(c1)C(F)(F)F |r|
NC(=O)c1ccnc2c(N[C@H](CN3CCC3)c3ccc(OC(F)(F)F)c(Cl)c3)ncnc12 |r|
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(OC(F)(F)F)c(Cl)c1 |r|
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(Cl)c(Cl)c1 |r|
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(C)c(c1)C(F)(F)F |r|
NC(=O)c1ccnc2c(NC3CNCCC3c3cccc(c3)C(F)(F)F)ncnc12
CNC[C@@H](Nc1ncnc2c(nccc12)C(N)=O)c1ccc(c(c1)C(F)(F)F)C(F)(F)F
CNC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(Cl)c(OC(F)(F)F)c1
CC(C)(C)NCCNc1ccc(nc1C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12)-c1cncc(F)c1
CC1(C)C(=O)Nc2ncnc(N3CCC(CC3)c3nc(ccc3NCCN3CCCC3)-c3ccc(F)nc3)c12
Cc1cc(-c2ccc(NCCN3CCCC3)c(n2)C2CCN(CC2)c2ncnc3NC(=O)C(C)(C)c23)n(C)n1
CC(C)(C)NCCNc1ccc(nc1C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12)-c1cnn(c1)C(F)F
CC(C)NCCNc1ccc(nc1C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12)-c1cnc(F)c(F)c1
CC(C)NCCNc1ccc(nc1C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12)-c1sc(C)nc1C
COc1cncc(c1)-c1ccc(NCCN2CCCC2)c(n1)C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12
CC1(C)C(=O)Nc2ncnc(N3CCC(CC3)c3nc(ccc3NCCN3CCCC3)-c3cncc(F)c3)c12
CN(C)CCNc1ccc(nc1C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12)-c1cc(Cl)nn1C
CC(C)NCCNc1ccc(nc1C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12)-c1cc(nn1C)C(F)(F)F
CC(C)NCCNc1ccc(nc1C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12)-c1cc(Cl)nn1C
CCNCCNc1ccc(nc1C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12)-c1cncc(F)c1
CC1C(=O)Nc2ncnc(N3CCC(CC3)c3nc(ccc3NCCN3CCCC3)-c3ccnc(F)c3)c12
CC1C(=O)Nc2ncnc(N3CCC(CC3)c3nc(ccc3NCCN3CCCC3)-c3ccoc3)c12
COc1cncc(c1)-c1ccc(NCCNC(C)C)c(n1)C1CCN(CC1)c1ncnc2NC(=O)C(C)c12
COc1cc(c(F)cn1)-c1ccc(NCCN2CCCC2)c(n1)C1CCN(CC1)c1ncnc2NC(=O)C(C)c12
CC1C(=O)Nc2ncnc(N3CCC(CC3)c3nc(ccc3NCCN3CCCC3)-c3cccnc3F)c12
CC1C(=O)Nc2ncnc(N3CCC(CC3)c3nc(ccc3NCCN3CCCC3)-c3ccsc3)c12
CC1C(=O)Nc2ncnc(N3CCC(CC3)c3nc(ccc3NCCN3CCCC3)-c3cncc(F)c3)c12
CC1C(=O)Nc2ncnc(N3CCC(CC3)c3nc(ccc3NCCN3CCCC3)-c3cc(nn3C)C(F)(F)F)c12
COc1cncc(c1)-c1ccc(NCCN(C)C)c(n1)C1CCN(CC1)c1ncnc2NC(=O)C(C)c12
CC1C(=O)Nc2ncnc(N3CCC(CC3)c3nc(ccc3NCCN(C)C)-c3ccsc3)c12
CC1C(=O)Nc2ncnc(N3CCC(CC3)c3nc(ccc3NCCN3CCCC3)-c3nccs3)c12
CC1C(=O)Nc2ncnc(N3CCC(=CC3)c3nc(ccc3NCCN3CCCC3)-c3cncc(F)c3)c12 |c:13|
CC(C)NCCNc1cc(F)c(nc1C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12)-c1cncc(F)c1
CC1C(=O)Nc2ncnc(N3CCN(CC3)c3nc(ccc3NCCN(C)C)-c3cncc(F)c3)c12
CC1(C)C(=O)Nc2ncnc(N3CCC(CC3)c3nc(ccc3NCCN3CCCC3)-c3nnc(o3)C(F)F)c12
CC(C)NCCNc1ccc(nc1C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12)-c1nnc(o1)C(F)F
CC(C)(C)NCCNc1ccc(nc1C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12)-c1nnc(o1)C(F)(F)F
CC(C)NCCNc1ccc(nc1C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12)-c1nnc(o1)C(F)(F)F
CN(CCNc1ccc(nc1C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12)-c1nnc(o1)C(F)(F)F)C(C)(C)C
CC1(C)C(=O)Nc2ncnc(N3CCC(CC3)c3nc(ccc3NCC3CCCN3)-c3nnc(o3)C(F)(F)F)c12
Cc1nnc(s1)-c1ccc(NCCN2CCCC2)c(n1)C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12
CC(C)(C)NCCNc1ccc(nc1C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12)-c1nnc(s1)C(F)F
CN(C)CCNc1ccc(nc1C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12)-c1nnc(s1)C(F)F
CC(C)NCCNc1ccc(nc1C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12)-c1nnc(s1)C(F)F
CC(C)(C)NCCNc1ccc(nc1C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12)-c1nnc(s1)C1CC1
CC(C)(C)NCCNc1ccc(nc1C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12)-c1noc(n1)C(F)F
CC(C)NCCNc1ccc(nc1C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12)-c1noc(n1)C(F)(F)F
CC(C)(C)NCCNc1ccc(nc1C1CCN(CC1)c1ncnc2NC(=O)C(C)(C)c12)-c1nc(no1)C(F)(F)F
CC1(C)C(=O)Nc2ncnc(N3CCC(CC3)c3nc(ccc3NCCN3CCCC3)-c3nc(no3)C(F)(F)F)c12
C=CC(=O)Nc1ccc2[nH]c(=O)n(C3CCN(Cc4ccc(cc4)-c4nc5cc[nH]c(=O)c5cc4-c4ccccc4)CC3)c2c1
CCC(=O)Nc1ccc2[nH]c(=O)n(C3CCN(Cc4ccc(cc4)-c4nc5cc[nH]c(=O)c5cc4-c4ccccc4)CC3)c2c1
C=CC(=O)Nc1cccc(c1)-c1cn(Cc2ccc(cc2)-c2nc3ccccn3c2-c2ccccc2)nn1
CCC(=O)Nc1cccc(c1)-c1cn(Cc2ccc(cc2)-c2nc3ccccn3c2-c2ccccc2)nn1
NC1(CCC1)c1ccc(cc1)-c1nc2ccn3c(n[nH]c3=O)c2cc1-c1ccccc1
CN(Cc1ccc(NC(=O)C=C)cc1)C1CCN(Cc2ccc(cc2)-c2nc3cc[nH]c(=O)c3cc2-c2ccccc2)CC1
CN(CCc1ccc(cc1)N(C)C(=O)C=C)Cc1ccc(cc1)-c1nc2ccn(C)c(=O)c2cc1-c1ccccc1
Clc1ccc(NC(=O)NC2CCN(Cc3ccc(cc3)-c3nc4cc[nH]c(=O)c4cc3-c3ccccc3)CC2)cc1NC(=O)C=C
C=CC(=O)Nc1ccc(cc1)N1CCN(Cc2ccc(cc2)-c2nc3cc[nH]c(=O)c3cc2-c2ccccc2)CC1
C=CC(=O)Nc1cccc(c1)C(=O)NC1CCN(Cc2ccc(cc2)-c2nc3cc[nH]c(=O)c3cc2-c2ccccc2)CC1
CCC(=O)Nc1cccc(c1)C(=O)NC1CCN(Cc2ccc(cc2)-c2nc3cc[nH]c(=O)c3cc2-c2ccccc2)CC1
Clc1cc2[nH]c(=O)n(N3CCN(Cc4ccc(cc4)-c4nc5cc[nH]c(=O)c5cc4-c4ccccc4)CC3)c2cc1NC(=O)C=C
O=C(Nc1cccc(c1)C(=O)NC1CCN(Cc2ccc(cc2)-c2nc3cc[nH]c(=O)c3cc2-c2ccccc2)CC1)C(=C\C1CC1)\C#N
CN(C)C\C=C\C(=O)Nc1ccc2[nH]c(=O)n(C3CCN(Cc4ccc(cc4)-c4nc5cc[nH]c(=O)c5cc4-c4ccccc4)CC3)c2c1
Cn1c2ccc(NC(=O)C=C)cc2n(C2CCN(Cc3ccc(cc3)-c3nc4cc[nH]c(=O)c4cc3-c3ccccc3)CC2)c1=O
Fc1cc(NC(=C)C=C)ccc1C(=O)NC1CCN(Cc2ccc(cc2)-c2nc3cc[nH]c(=O)c3cc2-c2ccccc2)CC1
C=CC(=O)Cc1ccc(s1)C(=O)NC1CCN(Cc2ccc(cc2)-c2nc3cc[nH]c(=O)c3cc2-c2ccccc2)CC1
C=CC(=O)Nc1ccccc1C(=O)NC1CCN(Cc2ccc(cc2)-c2nc3cc[nH]c(=O)c3cc2-c2ccccc2)CC1
C=CC(=O)Nc1ccc(cc1)C(=O)NC1CCN(Cc2ccc(cc2)-c2nc3cc[nH]c(=O)c3cc2-c2ccccc2)CC1
C[C@@H]1C[C@H](c2c1c(ncn2)N3CCN(CC3)C(=O)[C@H](CNC(C)C)c4ccc(cc4)Cl)O
c1cc(ccc1[C@H](CCO)NC(=O)C2(CCN(CC2)c3c4cc[nH]c4ncn3)N)Cl
Cc1c[nH]c2ncnc(N3CCC(N)(CC3)C(=O)N[C@@H](CC(C)(C)O)c3ccc(Cl)cc3)c12 |r|
Cc1c[nH]c2ncnc(N3CCC(N)(CC3)C(=O)N[C@@H](CCN3CCNCC3)c3ccc(Cl)cc3)c12 |r|
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2ccc(O)cc2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2ccccc2O)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2ccc(O)c(O)c2)cc1
COc1cc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)ccc1O
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2ccc(F)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2ccc(F)c(O)c2F)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2ccc(S(=O)(=O)O)cc2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2cccc(S(=O)(=O)O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2cccc(S(=O)(=O)O)c2F)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2cccc(S(N)(=O)=O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2ccc(S(N)(=O)=O)cc2)cc1
CCS(=O)(=O)c1cccc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)c1
CCS(=O)(=O)c1cccc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)n1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2ccc(C(=O)O)cc2)cc1
Cc1cc(C(=O)O)ccc1C(=O)NCc1ccc(-n2c(-c3cccnc3N)nc3ccc(-c4ccccc4)nc32)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2ccc(C(=O)O)cc2F)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2cccc(C(=O)O)c2)cc1
Cc1c(C(=O)O)cccc1C(=O)NCc1ccc(-n2c(-c3cccnc3N)nc3ccc(-c4ccccc4)nc32)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2cccc(C(=O)O)c2F)cc1
COC(=O)c1cc(F)cc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)c1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2cc(F)cc(C(=O)O)c2)cc1
COC(=O)c1ccc(F)c(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)c1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2cc(C(=O)O)ccc2F)cc1
N#Cc1cc(C(=O)O)cc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)c1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2cc(O)cc(C(=O)O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2cccc(C(=O)O)c2O)cc1
CN(C)c1cc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)ccc1C(=O)O
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2cccc(C(=O)O)n2)cc1
COC(=O)Cc1ccc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2ccc(CC(=O)O)cc2)cc1
COC(=O)Cc1cccc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)c1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2cccc(CC(=O)O)c2)cc1
COC(=O)Cc1cccc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)c1F
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2cccc(CC(=O)O)c2F)cc1
CC(C(=O)O)c1ccc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)cc1
CC(C(=O)O)c1cccc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)c1
CC(C(=O)O)c1cccc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)c1F
CC(C(=O)O)c1cccc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)n1
COC(=O)CCc1ccc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2ccc(CCC(=O)O)cc2)cc1
COC(=O)CCc1cccc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)c1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2cccc(CCC(=O)O)c2)cc1
NC(=O)Cc1cccc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)c1
CCNC(=O)Cc1cccc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)c1
Nc1ccc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNCc2ccc(C(=O)O)cc2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNCc2cccc(CC(=O)O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2cccc(CC(=O)O)c2)nc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2cccc(CC(=O)O)c2)cn1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2cccc(CC(=O)O)c2)c(F)c1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)cc2n1-c1ccc(CNC(=O)c2cccc(CC(=O)O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(C(=O)NCc2cccc(CC(=O)O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NC(=O)c2ccc(C(=O)O)cc2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NC(=O)c2cccc(C(=O)O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NC(=O)c2cccc(C(=O)O)c2F)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NC(=O)c2cccc(CC(=O)O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NC(=O)c2cccc(CCC(=O)O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NCc2ccc(C(=O)O)cc2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NC(=O)c2ccc(C(=O)O)cc2)nc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NC(=O)c2cccc(C(=O)O)c2)nc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NC(=O)c2cccc(C(=O)O)c2F)nc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NC(=O)c2ccc(C(=O)O)cc2F)nc1
Cc1cc(C(=O)O)ccc1C(=O)Nc1ccc(-n2c(-c3cccnc3N)nc3ccc(-c4ccccc4)nc32)cn1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NC(=O)c2cccc(CC(=O)O)c2)nc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NC(=O)c2cccc(C(=O)O)c2F)c(F)c1
Cc1cc(C(=O)O)ccc1C(=O)Nc1ccc(-n2c(-c3cccnc3N)nc3ccc(-c4ccccc4)nc32)cc1F
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NC(=O)c2cccc(CC(=O)O)c2)c(F)c1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NCc2ccc(C(=O)O)cc2F)nc1
COC(=O)c1ccc(C(=O)N2CC(c3ccc(-n4c(-c5cccnc5N)nc5ccc(-c6ccccc6)nc54)cc3)C2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(C2CN(C(=O)c3ccc(C(=O)O)cc3)C2)cc1
COC(=O)c1cccc(C(=O)N2CC(c3ccc(-n4c(-c5cccnc5N)nc5ccc(-c6ccccc6)nc54)cc3)C2)c1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(C2CN(C(=O)c3cccc(C(=O)O)c3)C2)cc1
COC(=O)c1ccccc1C(=O)N1CC(c2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)C1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(C2CN(C(=O)c3ccccc3C(=O)O)C2)cc1
Cc1cc(C(=O)O)ccc1C(=O)N1CC(c2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)C1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(C2CN(C(=O)c3ccc(C(=O)O)cc3F)C2)cc1
Cc1c(C(=O)O)cccc1C(=O)N1CC(c2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)C1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(C2CN(C(=O)c3cccc(C(=O)O)c3F)C2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(C2CN(Cc3cccc(CC(=O)O)c3)C2)cc1
CC(=O)Nc1ccc(-c2ccc3nc(-c4cccnc4N)n(-c4ccc(CNC(=O)c5cccc(CC(=O)O)c5)cc4)c3n2)cc1
CC(=O)Nc1cccc(-c2ccc3nc(-c4cccnc4N)n(-c4ccc(CNC(=O)c5cccc(CC(=O)O)c5)cc4)c3n2)c1
Nc1ncccc1-c1nc2cc(-c3ccccc3)cnc2n1-c1ccc(CNC(=O)c2cccc(CC(=O)O)c2)cc1
CC(=O)Nc1cccc(-c2cnc3c(c2)nc(-c2cccnc2N)n3-c2ccc(CNC(=O)c3cccc(CC(=O)O)c3)cc2)c1
CC(=O)Nc1ccc(-c2cnc3c(c2)nc(-c2cccnc2N)n3-c2ccc(CNC(=O)c3cccc(CC(=O)O)c3)cc2)cc1
Nc1ncccc1-c1nc2cc(-c3cccc(NC(=O)c4ccccc4)c3)cnc2n1-c1ccc(CNC(=O)c2cccc(CC(=O)O)c2)cc1
Nc1ncccc1-c1nc2cc(-c3ccc(NC(=O)c4ccccc4)cc3)cnc2n1-c1ccc(CNC(=O)c2cccc(CC(=O)O)c2)cc1
COC(=O)Cc1ccc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4cc(-c5cccnc5)cnc43)cc2)cc1
Nc1ncccc1-c1nc2cc(-c3cccnc3)cnc2n1-c1ccc(CNC(=O)c2ccc(CC(=O)O)cc2)cc1
COC(=O)Cc1cccc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4cc(-c5cccnc5)cnc43)cc2)c1
Nc1ncccc1-c1nc2cc(-c3cccnc3)cnc2n1-c1ccc(CNC(=O)c2cccc(CC(=O)O)c2)cc1
COC(=O)CCc1ccc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4cc(-c5cccnc5)cnc43)cc2)cc1
Nc1ncccc1-c1nc2cc(-c3cccnc3)cnc2n1-c1ccc(CNC(=O)c2ccc(CCC(=O)O)cc2)cc1
COC(=O)CCc1cccc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4cc(-c5cccnc5)cnc43)cc2)c1
Nc1ncccc1-c1nc2cc(-c3cccnc3)cnc2n1-c1ccc(CNC(=O)c2cccc(CCC(=O)O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3cccnc3)nc2n1-c1ccc(CNC(=O)c2ccc(CC(=O)O)cc2)cc1
Nc1ncccc1-c1nc2ccc(-c3cccnc3)nc2n1-c1ccc(CNC(=O)c2cccc(CC(=O)O)c2)cc1
NC(=O)c1cnc2c(c1)nc(-c1cccnc1N)n2-c1ccc(CNC(=O)c2cccc(CC(=O)O)c2)cc1
Nc1ncccc1-c1nc2cc(C(F)(F)F)cnc2n1-c1ccc(CNC(=O)c2ccc(C(=O)O)cc2)cc1
Nc1ncccc1-c1nc2ccc(C(F)(F)F)nc2n1-c1ccc(CNC(=O)c2ccc(C(=O)O)cc2)cc1
COC(=O)Cc1cccc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4cccnc43)cc2)c1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CNC(=O)c2cccc(CC(=O)O)c2)cc1
COc1ccc2nc(-c3cccnc3N)n(-c3ccc(CNC(=O)c4ccc(C(=O)O)cc4C)cc3)c2c1
COc1ccc2nc(-c3cccnc3N)n(-c3ccc(CNC(=O)c4cccc(C(=O)O)c4F)cc3)c2c1
COc1ccc2nc(-c3cccnc3N)n(-c3ccc(CNC(=O)c4cccc(CC(=O)O)c4)cc3)c2c1
Cc1cc(C(=O)O)ccc1C(=O)NCc1ccc(-n2c(-c3cccnc3N)nc3ccc(C(F)(F)F)cc32)cc1
Nc1ncccc1-c1nc2ccc(C(F)(F)F)cc2n1-c1ccc(CNC(=O)c2cccc(C(=O)O)c2F)cc1
Nc1ncccc1-c1nc2ccc(C(F)(F)F)cc2n1-c1ccc(CNC(=O)c2cccc(CC(=O)O)c2)cc1
Nc1ncccc1-c1nc2ccccc2n1-c1ccc(CNC(=O)c2cccc(CC(=O)O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccc(F)cc3)nc2n1-c1ccc(NC(=O)c2ccc(C(=O)O)cc2)nc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NC(=O)c2ccc(C(=O)O)c(F)c2)nc1
Cc1cc(C(=O)Nc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cn2)ccc1C(=O)O
C[C@H](c1ccc(C(=O)O)cc1)N1CC(c2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)C1
C[C@@H](c1ccc(C(=O)O)cc1)N1CC(c2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)C1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(C2CCN(Cc3ccc(C(=O)O)cc3)CC2)cc1
Cc1cc(C(=O)Nc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cn2)c(F)cc1C(=O)O
Cc1cc(C(=O)Nc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cn2)c(C)cc1C(=O)O
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NC(=O)c2cc(F)c(C(=O)O)cc2F)nc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NC(=O)c2ccc(C(=O)O)cc2F)nc1
Cc1cc(C(=O)O)c(F)cc1C(=O)Nc1ccc(-n2c(-c3cccnc3N)nc3ccc(-c4ccccc4)nc32)cn1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NC(=O)c2cc(F)c(C(=O)O)c(F)c2)nc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NC(=O)c2ccc(C(=O)O)nc2)nc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NC(=O)c2cc(F)c(C(=O)O)cc2F)nc1
Cc1nc(NC(=O)c2ccc(C(=O)O)cc2)ccc1-n1c(-c2cccnc2N)nc2ccc(-c3ccccc3)nc21
Cc1nc(NC(=O)c2ccc(C(=O)O)c(F)c2)ccc1-n1c(-c2cccnc2N)nc2ccc(-c3ccccc3)nc21
Cc1cc(C(=O)Nc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)c(C)n2)c(C)cc1C(=O)O
Cc1cc(C(=O)Nc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)c(C)n2)ccc1C(=O)O
COC(=O)c1ccc([C@@H](C)N2CC(c3ccc(-n4c(-c5cccnc5N)nc5ccc(-c6ccccc6)nc54)cc3)C2)cc1
COC(=O)c1ccc([C@H](C)N2CC(c3ccc(-n4c(-c5cccnc5N)nc5ccc(-c6ccccc6)nc54)cc3)C2)cc1
C[C@@H](c1ccc(C(=O)O)cc1F)N1CC(c2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)C1
C[C@H](c1ccc(C(=O)O)cc1F)N1CC(c2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)C1
CC(C)[C@H](c1ccc(C(=O)O)cc1)N1CC(c2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)C1
CC(C)[C@@H](c1ccc(C(=O)O)cc1)N1CC(c2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)C1
CC(c1ccc(C(=O)O)c(F)c1)N1CC(c2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)C1
C[C@@H](c1ccc(C(=O)O)cc1C(F)(F)F)N1CC(c2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)C1
CC(c1ccc(C(=O)O)cc1)N1CC(c2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2F)C1
CC(c1ccc(C(=O)O)cc1)N1CC(c2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cn2)C1
Cc1nc(NC(=O)c2ccc(C(=O)O)cc2)ccc1-n1c(-c2cccnc2N)nc2ccc(-c3ccccc3)cc21
CC(c1ccc(C(=O)O)cc1)N1CCC(c2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)CC1
CC(c1ccc(C(=O)O)cc1)N1CCCC(c2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)C1
CC(c1ccc(C(=O)O)cc1)N1CCC(c2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)C1
CC(C)c1ccc2nc(-c3cccnc3N)n(-c3ccc(NC(=O)c4ccc(C(=O)O)cc4)nc3)c2c1
CC(C)c1ccc2nc(-c3cccnc3N)n(-c3ccc(C4CN(Cc5ccc(C(=O)O)cc5)C4)cc3)c2n1
CC(C)(C)c1ccc2nc(-c3cccnc3N)n(-c3ccc(NC(=O)c4ccc(C(=O)O)cc4)nc3)c2c1
Nc1ncccc1-c1nc2ccc(OC(F)(F)F)cc2n1-c1ccc(NC(=O)c2ccc(C(=O)O)cc2)nc1
CC(C)Oc1ccc2nc(-c3cccnc3N)n(-c3ccc(NC(=O)c4ccc(C(=O)O)cc4)nc3)c2c1
Cc1cc(NC(=O)c2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cn2)ccc1C(=O)O
Cc1cc(C(=O)O)ccc1NC(=O)c1ccc(-n2c(-c3cccnc3N)nc3ccc(-c4ccccc4)nc32)cn1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(C(=O)Nc2ccc(C(=O)O)cc2F)nc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(C(=O)Nc2ccc(C(=O)O)cc2F)cc1
Cc1cc(C(=O)Nc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)nc2C)ccc1C(=O)O
Cc1nc(NC(=O)c2ccc(C(=O)O)cc2)ccc1-n1c(-c2cccnc2N)nc2ccc(-c3ccccc3)cc21
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(C2CN(Cc3ccc(C(=O)O)cc3)C2)cc1
COc1cc(CN2CC(c3ccc(-n4c(-c5cccnc5N)nc5ccc(-c6ccccc6)nc54)cc3)C2)ccc1C(=O)O
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(C2CN(Cc3cc(O)c(C(=O)O)c(F)c3)C2)cc1
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|
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|
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|
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|
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|
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|
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|
[H][C@]12C[C@@]1([H])N(CCN2C(=O)[C@H](CNC(C)C)c1ccc(Cl)cc1)c1ncnc2NC(=O)C[C@@H](C)c12 |r|
[H][C@@]12C[C@]1([H])N(CCN2C(=O)[C@H](CNC(C)C)c1ccc(Cl)cc1)c1ncnc2NC(=O)C[C@@H](C)c12 |r|
C[C@@H]1CC(=O)Nc2ncnc(N3CCN([C@H]4C[C@@H]34)C(=O)[C@H](CNC3CC3)c3ccc(Cl)cc3)c12
[H][C@@]12C[C@]1([H])N(CCN2C(=O)[C@H](CNC1CC1)c1ccc(Cl)cc1)c1ncnc2NC(=O)C[C@@H](C)c12 |r|
CC(C)NC[C@@H](C(=O)N1CCN([C@@H]2C[C@H]12)c1ncnc2NC(=O)O[C@@H](C)c12)c1ccc(Cl)cc1
CC(C)NC[C@@H](C(=O)N1CCN([C@@H]2C[C@H]12)c1ncnc2NC(=O)O[C@H](C)c12)c1ccc(Cl)cc1
CC(C)NC[C@@H](C(=O)N1CCN([C@H]2C[C@@H]12)c1ncnc2NC(=O)O[C@H](C)c12)c1ccc(Cl)cc1
[H][C@@]12C[C@]1([H])N(CCN2C(=O)[C@H](CNC(C)C)c1ccc(Cl)cc1)c1ncnc2NC(=O)O[C@@H](C)c12 |r|
Nc1ncccc1-c1nc2ccc(-c3ccc(N4CCOCC4)cc3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2)cc1
CC(=O)Nc1cccc(-c2ccc3nc(-c4cccnc4N)n(-c4ccc(CNC(=O)Cc5ccc(C=O)c(O)c5)cc4)c3n2)c1
Nc1ncccc1-c1nc2ccc(N3CCOCC3)nc2n1-c1ccc(CNC(=O)c2ccc(O)c(C=O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2cc(C=O)c(O)cc2F)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2C(F)(F)F)cc1
Nc1ncccc1-c1nc2ccc(C3CC3C(=O)N3CCOCC3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(C(F)F)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(N3CC4CCC(C3)O4)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(N3C4CCC3COC4)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(OC3CC3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CC(=O)NC2(c3ccc(C=O)c(O)c3)CC2)cc1
Nc1ncccc1-c1nc2ccc(-c3cccc(N4CCOCC4)c3)nc2n1-c1ccc(CNC(=O)c2cc(F)c(O)c(C=O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3cccc(N4CCOCC4)c3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2Cl)cc1
Cc1c(CC(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)ccc(C=O)c1O
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2ccc(O)c(C=O)c2F)cc1
Nc1ncccc1-c1nc2ccc(C3CC3)nc2n1-c1ccc(CNCCc2ccc(C=O)c(O)c2)cc1
CC(C)(O)c1ccc2nc(-c3cccnc3N)n(-c3ccc(CNC(=O)Cc4ccc(C=O)c(O)c4)cc3)c2n1
CC1(c2ccc3nc(-c4cccnc4N)n(-c4ccc(CNC(=O)Cc5ccc(C=O)c(O)c5)cc4)c3n2)CC1
Nc1ncccc1-c1nc2ccc(-c3cccc(N4CCOCC4)c3)nc2n1-c1ccc(CCNCc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3cccc(N4CCOCC4)c3)nc2n1-c1ccc(CNC(=O)c2ccc(O)c(C=O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3cccc(N4CCOCC4)c3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)cc2F)cc1
Nc1ncccc1-c1nc2ccc(C3CC3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2Cl)cc1
CCc1ccc2nc(-c3cccnc3N)n(-c3ccc(CNC(=O)Cc4ccc(C=O)c(O)c4)cc3)c2n1
Cc1ccc2nc(-c3cccnc3N)n(-c3ccc(CNC(=O)Cc4ccc(C=O)c(O)c4)cc3)c2n1
Nc1ncccc1-c1nc2ccc(NC3CC3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(C3CC3)nc2n1-c1ccc(CNC(=O)C(F)c2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(C3CC3)nc2n1-c1ccc(CNC(=O)c2ccc(O)c(C=O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NC(=O)Cc2ccc(O)c(C=O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(C(=O)NCc2ccc(O)c(C=O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(C(CO)NC(=O)Cc2ccc(C=O)c(O)c2F)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(C2(NC(=O)Cc3ccc(C=O)c(O)c3F)CC2)cc1
Cn1cc(-c2ccc3nc(-c4cccnc4N)n(-c4ccc(CNC(=O)Cc5ccc(C=O)c(O)c5)cc4)c3n2)cn1
COc1ccc2nc(-c3cccnc3N)n(-c3ccc(CNC(=O)Cc4ccc(C=O)c(O)c4)cc3)c2n1
Nc1ncccc1-c1nc2ccc(-c3ccnc(N4CCOCC4)c3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-n3cccn3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CCNCCc2ccc(C=O)c(O)c2)cc1
CC(C(=O)NCc1ccc(-n2c(-c3cccnc3N)nc3ccc(-c4ccccc4)nc32)cc1)c1ccc(C=O)c(O)c1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(N2CC(NCc3ccc(C=O)c(O)c3)C2)cc1
CN(CCc1ccc(-n2c(-c3cccnc3N)nc3ccc(-c4ccccc4)nc32)cc1)Cc1ccc(C=O)c(O)c1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CCNCc2ccc(C=O)c(O)c2F)cc1
CC(C)(C)c1cc(C(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)cc(C=O)c1O
Nc1ncccc1-c1nc2ccc(-c3cccc(N4CCC(N5CCCC5=O)CC4)c3F)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2)cc1
CN(C)C(=O)Nc1cc(CC(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4cccnc43)cc2)ccc1C=O
Cn1cc(C(=O)Nc2cc(CC(=O)NCc3ccc(-n4c(-c5cccnc5N)nc5cccnc54)cc3)ccc2C=O)cn1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CNC(=O)c2cc(C=O)c(O)cn2)cc1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CNC(=O)c2cnc(O)c(C=O)c2)cc1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CNC(=O)c2ccc(O)c(C=O)n2)cc1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(NC(=O)C3CC3)c2)cc1
Nc1ncccc1-c1nc2ccc(N3CCOCC3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2cc(Br)c(O)c(C=O)c2)cc1
CC(C)(O)C#Cc1ccc2nc(-c3cccnc3N)n(-c3ccc(CNC(=O)Cc4ccc(C=O)c(O)c4)cc3)c2n1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2cc(Cl)c(O)c(C=O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2cc(F)c(O)c(C=O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3F)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3cccc(N4CCOCC4)c3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)C2(c3cnc(C=O)c(O)c3)CC2)cc1
CN(CCc1ccc(C=O)c(O)c1)C(=O)c1ccc(-n2c(-c3cccnc3N)nc3ccc(-c4ccccc4)nc32)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CC(=O)NCc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CN(C=O)C2(c3ccc(C=O)c(O)c3F)CC2)cc1
CC(C)(C(=O)NCc1ccc(-n2c(-c3cccnc3N)nc3ccc(-c4ccccc4)nc32)cc1)c1ccc(C=O)c(O)c1
Nc1ncccc1-c1nc2ccc(-c3ccncc3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccn3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2)cc1
CN(Cc1ccc(-n2c(-c3cccnc3N)nc3ccc(-c4ccccc4)nc32)cc1)C(=O)Cc1ccc(C=O)c(O)c1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)C(F)c2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(C3CC3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3cccnc3)nc2n1-c1ccc(CNC(=O)C2(c3ccc(C=O)c(O)c3F)CC2)cc1
Nc1ncccc1-c1nc2ccc(-c3cccnc3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)C2(c3ccc(C=O)c(O)c3)CC2)cc1
Nc1ncccc1-c1nc2ccc(-c3cccnc3)nc2n1-c1ccc(CNC(=O)C2(c3ccc(C=O)c(O)c3)CC2)cc1
Nc1ncccc1-c1nc2ccc(-c3cccnc3)nc2n1-c1ccc(CNC(=O)c2ccc(O)c(C=O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CCNCc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2ccc(O)c(C=O)c2)cc1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CNC(=O)C(F)c2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)n2)cc1
COc1c(CCNCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)ccc(C=O)c1O
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)Cc2cnc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CNC(=O)C(F)(F)c2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3cccnc3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2F)cc1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CNCCc2ccc(C=O)c(C(F)F)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNc2cc(-c3ccc(O)c(C=O)c3)ccn2)cc1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CNC(=O)C2(c3ccc(C=O)c(O)c3)CC2)cc1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CNC(=O)c2ccc(O)c(C=O)c2)cc1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CNC(=O)c2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2ccc(C=O)c(O)c2F)cc1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CCC(=O)Nc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNc2cc(-c3ccc(C=O)c(O)c3)ccn2)cc1
Nc1ncccc1-c1nc2ccc(-c3cccnc3)nc2n1-c1ccc(CNCCc2ccc(C=O)c(O)c2F)cc1
CC(=O)Nc1c(C=O)ccc(CCNCc2ccc(-n3c(-c4cccnc4N)nc4cccnc43)cc2)c1F
CC(=O)Nc1c(C=O)ccc(CCNCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)c1F
CC(=O)Nc1cc(CC(=O)NCc2ccc(-n3c(-c4cccnc4N)nc4cccnc43)cc2)ccc1C=O
C[C@H](NCCc1ccc(O)c(C=O)c1)c1ccc(-n2c(-c3cccnc3N)nc3ccc(-c4ccccc4)nc32)cc1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2F)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2F)cc1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CNCCc2ccc(C=O)c(O)c2F)cc1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2)cc1
COc1cc(CCNCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)ccc1C=O
CC(=O)Nc1cc(CCNCc2ccc(-n3c(-c4cccnc4N)nc4cccnc43)cc2)ccc1C=O
Nc1ncccc1-c1nc2ccc(Cl)nc2n1-c1ccc(CNCCc2ccc(C=O)c(O)c2)cc1
CN(C(=O)CCc1ccc(C=O)c(O)c1)c1ccc(-n2c(-c3cccnc3N)nc3ccc(-c4ccccc4)nc32)cc1
CS(=O)(=O)Nc1cccc(-c2ccc3nc(-c4cccnc4N)n(-c4ccc(CNCCc5ccc(C=O)c(O)c5)cc4)c3n2)c1
CC(=O)Nc1cccc(-c2ccc3nc(-c4cccnc4N)n(-c4ccc(CNCCc5ccc(C=O)c(O)c5F)cc4)c3n2)c1
Nc1ncccc1-c1nc2ccc(-c3ccccn3)nc2n1-c1ccc(CNCCc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(C(=O)NCC#Cc2ccc(C=O)c(O)c2)cc1
C[C@@H](NCCc1ccc(O)c(C=O)c1)c1ccc(-n2c(-c3cccnc3N)nc3ccc(-c4ccccc4)nc32)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(S(=O)(=O)NCCc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(N3CCOCC3)nc2n1-c1ccc(CNCCc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3cccc(N4CCOCC4)c3)nc2n1-c1ccc(CNCCc2ccc(C=O)c(O)c2)cc1
CC(=O)N(C)C1CCN(c2cccc(-c3ccc4nc(-c5cccnc5N)n(-c5ccc(CNCCc6ccc(C=O)c(O)c6)cc5)c4n3)c2)CC1
CC(=O)Nc1cc(CCNCc2ccc(-n3c(-c4cccnc4N)nc4ccc(-c5ccccc5)nc43)cc2)ccc1C=O
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CCNC(=O)c2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(C(=O)NCCc2ccc(C=O)c(O)c2)cn1
Nc1ncccc1-c1nc2ccc(-c3cccnc3)nc2n1-c1ccc(CNCCc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CNCCc2ccc(C=O)c(O)c2)cc1
CC(NC(=O)Cc1ccc(O)c(C=O)c1)c1ccc(-n2c(-c3cccnc3N)nc3ccc(-c4ccccc4)nc32)cc1
CC(NC(=O)Cc1ccc(C=O)c(O)c1)c1ccc(-n2c(-c3cccnc3N)nc3ccc(-c4ccccc4)nc32)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)CCc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(NC(=O)CCc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccncc3)nc2n1-c1ccc(CNCCc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNCCc2ccc(C=O)c(O)c2Cl)cc1
CC(=O)Nc1cccc(-c2ccc3nc(-c4cccnc4N)n(-c4ccc(CNCCc5ccc(C=O)c(O)c5)cc4)c3n2)c1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNCCc2ccc(C=O)c(O)c2F)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNCCc2cc(O)c(C=O)c(F)c2)cc1
Nc1ncccc1-c1nc2cc(-c3ccccc3)cnc2n1-c1ccc(CNCCc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNCCc2ccc(C=O)cc2)cc1
CC(NCCc1ccc(O)c(C=O)c1)c1ccc(-n2c(-c3cccnc3N)nc3ccc(-c4ccccc4)nc32)cc1
CC(NCCc1ccc(C=O)c(O)c1)c1ccc(-n2c(-c3cccnc3N)nc3ccc(-c4ccccc4)nc32)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNCCc2cc(O)c(C=O)cc2F)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNCCCc2ccc(O)c(C=O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNCCCc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(C(=O)NCCc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)Cc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNCCc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(C2(NCCc3ccc(C=O)c(O)c3)CCC2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNCCc2ccc(O)c(C=O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CN2CCC(c3ccc(O)c(C=O)c3)CC2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(C(=O)NCc2ccc(C=O)c(O)c2)cc1
Nc1ncccc1-c1nc2ccc(-c3ccccc3)nc2n1-c1ccc(CNC(=O)c2ccc(C=O)c(O)c2)cc1
Cc1ccc2nc(-c3cccnc3N)n(-c3ccc(C4(NC(=O)Cc5ccc(C=O)c(O)c5F)CC4)cc3)c2n1
Nc1ncccc1-c1nc2ccc(N3CCOCC3)nc2n1-c1ccc(C2(NC(=O)Cc3ccc(C=O)c(O)c3F)CC2)cc1
Nc1ncccc1-c1nc2ccc(-n3cccn3)nc2n1-c1ccc(C2(NC(=O)Cc3ccc(C=O)c(O)c3F)CC2)cc1
Nc1ncccc1-c1nc2ccc(nc2n1-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
C#Cc1cccc(-c2ccc3nc(-c4cccnc4N)n(-c4ccc(CNC(=O)c5ccc(C=O)c(O)c5)cc4)c3n2)c1
C#Cc1cccc(-c2ccc3nc(-c4cccnc4N)n(-c4ccc(CNCCc5ccc(C=O)c(O)c5)cc4)c3n2)c1
Nc1ccccc1SC(=N)C(C#N)C(C#N)C(=N)Sc1ccccc1N
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCN(CC1)C1CCNCC1
Oc1cccc(Nc2ccnc3[nH]c4ccccc4c23)c1
CC(C)(C)CNC(=O)CC1CNC(=O)c2cc(cn12)-c1ccsc1
CN1CCN(C[C@@H](NC(=O)C[C@H]2CNC(=O)c3cc(cn23)-c2cccc(Cl)c2)C2CCCCC2)CC1 |r|
COC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(N)=N)C(=O)NCCCC(O)=O |r|
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)C=C |r|
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCI |r|
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCBr |r|
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCl |r|
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCN1C(=O)C=CC1=O |r,c:25|
CC(C)(C)OC(=O)NN(Cc1ccccc1)C(=O)CCl
CC(C)(C)OC(=O)NN(Cc1ccccc1)C(=O)CBr
CC(C)(C)OC(=O)NN(Cc1ccccc1)C(=O)CI
CC(C)(C)OC(=O)NN(Cc1ccccc1)C(=O)C=C
CC(C)(C)OC(=O)NN(Cc1ccccc1)C(=O)CN1C(=O)C=CC1=O |c:23|
CCC(=O)C(Cc1ccccc1)NC(=O)OC(C)(C)C
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)NC)OC
NCC(Cc1ccccc1)NC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12
NCC(NC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12)c1ccccc1
NC[C@H](Cc1ccc(cc1)C(F)(F)F)NC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12 |r|
NC[C@H](Cc1cccc(c1)C(F)(F)F)NC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12 |r|
NC[C@H](CC1CCCCC1)NC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12 |r|
NC[C@H](Cc1cccc(F)c1)NC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12 |r|
NC[C@H](Cc1ccc(F)cc1)NC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12 |r|
NC[C@H](Cc1ccccc1C(F)(F)F)NC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12 |r|
NC[C@@H](Cc1ccccc1)NC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12 |r|
COc1ccc(C[C@@H](CN)NC(=O)c2cc(Br)c(s2)-c2ccnc3[nH]ccc23)cc1 |r|
NC[C@H](Cc1ccccc1)NC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12 |r|
N[C@H](CCc1cc(no1)-c1ccc2cnccc2c1)Cc1ccc(cc1)C(F)(F)F |r|
Cn1c2cc(ccc2[nH]c1=O)-c1cnc(NC[C@@H](N)Cc2ccc(cc2)C(F)(F)F)s1 |r|
N[C@H](CNc1ncc(s1)-c1ccc2NC(=O)Cc2c1)Cc1ccc(cc1)C(F)(F)F |r|
N[C@H](CNc1ncc(s1)-c1ccc2[nH]c(=O)oc2c1)Cc1ccc(cc1)C(F)(F)F |r|
N[C@H](CNc1ncc(s1)-c1ccc2[nH]ncc2c1)Cc1ccc(cc1)C(F)(F)F |r|
N[C@H](CNc1ncc(s1)-c1ccc2[nH]c(=O)sc2c1)Cc1ccc(cc1)C(F)(F)F |r|
N[C@H](CNc1nnc(s1)-c1ccc2cnccc2c1)Cc1ccc(cc1)C(F)(F)F |r|
N[C@H](CNc1ncc(s1)-c1ccc2cnc(N)cc2c1)Cc1ccc(cc1)C(F)(F)F |r|
N[C@H](CNc1ncc(s1)-c1ccc2cnccc2c1)Cc1ccc(cc1)C(F)(F)F |r|
N[C@H](CNc1ncc(s1)-c1ccc2C(=O)NCc2c1)Cc1ccc(cc1)C(F)(F)F |r|
N[C@H](CNc1ncc(s1)-c1ccc2cncnc2c1)Cc1ccc(cc1)C(F)(F)F |r|
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)N(C)C(=O)c9ccccc9)OC
C[C@@]12[C@](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)(CO)O
CN1CCN(CC1)CC(=O)N(C)c2ccc(cc2)N/C(=C\3/c4ccc(cc4NC3=O)C(=O)OC)/c5ccccc5
Cc1cn2c(cnc2c(Nc2cc(CN3CCC(F)(F)C3)ns2)n1)-c1cn[nH]c1
C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(CC3)C(=O)[C@H](CNC(C)(C)CO)c3ccc(Cl)cc3)c12 |r|
C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(CC3)C(=O)[C@H](CNC(C)(C)CO)c3ccc(c(F)c3)C(F)(F)F)c12 |r|
C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(CC3)C(=O)[C@H]([C@@H]3CCCN3)c3ccc(Cl)cc3)c12 |r|
C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(CC3)C(=O)[C@H](CNC(C)(C)C)c3ccc(c(F)c3)C(F)(F)F)c12 |r|
COCCNC[C@@H](C(=O)N1CCN(CC1)c1ncnc2[C@H](O)C[C@@H](C)c12)c1ccc(Cl)cc1 |r|
C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(CC3)C(=O)[C@H](CNC3CCCCC3)c3ccc(Cl)cc3)c12 |r|
CC(C)N(C)C[C@@H](C(=O)N1CCN(CC1)c1ncnc2[C@H](O)C[C@@H](C)c12)c1ccc(Cl)cc1 |r|
C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(CC3)C(=O)[C@H](CNC3CCOCC3)c3ccc(Cl)c(F)c3)c12 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2CC[C@@H](C)c12)c1ccc(Cl)cc1 |r|
C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(CC3)C(=O)[C@H](CN3CCC(F)CC3)c3ccc(Cl)cc3)c12 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2[C@@H](F)C[C@@H](C)c12)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2c1[C@H](C)CC2(F)F)c1ccc(Cl)cc1 |r|
C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(CC3)C(=O)[C@H](CNCC3CC3)c3ccc(c(F)c3)C(F)(F)F)c12 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2[C@@H](O)C[C@@H](C)c12)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2[C@H](F)C[C@@H](C)c12)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2CC[C@@H](CO)c12)c1ccc(Cl)cc1 |r|
CO[C@H]1CC[C@@H](CC1)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2[C@H](O)C[C@@H](C)c12)c1ccc(Cl)cc1 |r,wU:27.29,10.10,5.8,wD:24.26,2.1,(22.8,-34.77,;21.46,-35.53,;21.46,-37.07,;20.12,-37.83,;20.11,-39.37,;21.44,-40.13,;22.77,-39.38,;22.78,-37.85,;21.44,-41.67,;20.11,-42.44,;20.11,-43.98,;21.44,-44.75,;22.78,-43.98,;21.44,-46.3,;20.11,-47.07,;20.11,-48.61,;21.44,-49.38,;22.78,-48.61,;22.78,-47.07,;21.44,-50.92,;22.78,-51.68,;22.77,-53.23,;21.43,-54,;20.09,-53.22,;18.64,-53.7,;18.17,-55.16,;17.74,-52.46,;18.63,-51.21,;18.15,-49.75,;20.09,-51.69,;18.77,-44.75,;18.77,-46.29,;17.45,-47.06,;16.1,-46.29,;14.77,-47.06,;16.1,-44.75,;17.44,-43.97,)|
C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(CC3)C(=O)[C@H](CNCC3CCOCC3)c3ccc(Cl)cc3)c12 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2CC[C@@H](C=C)c12)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2CC[C@@H](CF)c12)c1ccc(Cl)cc1 |r|
C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(CC3)C(=O)[C@H](CNC3CCOCC3)c3ccc(Cl)cc3)c12 |r|
C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(CC3)C(=O)[C@H](CNCCF)c3ccc(Cl)cc3)c12 |r|
C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(CC3)C(=O)[C@H](CN)c3ccc(Cl)cc3)c12 |r|
C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(CC3)C(=O)[C@H](CNCC3CC3)c3ccc(Cl)cc3)c12 |r|
C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(CC3)C(=O)[C@H](CN)c3ccc(cc3)C(F)(F)F)c12 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2[C@H](O)C[C@@H](C)c12)c1ccc(Cl)c(F)c1 |r|
C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(CC3)C(=O)[C@H]([C@@H]3CCCCN3)c3ccc(Cl)cc3)c12 |r|
C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(CC3)C(=O)[C@H]([C@@H]3COCCN3)c3ccc(Cl)cc3)c12 |r|
CCN(CC)CC=Cc1[nH]c(=O)c2c3n(C)c(Nc4c(Cl)cccc4Cl)nc3ccc2c1C |w:6.5|
NC(=O)c1cc([nH]c1-c1ccccc1)-c1ccnc(N)n1
CC(=O)c1ccc(cc1)N2CCN(CC2)C(=O)CN3CC[C@H](C3)C(=O)Nc4ccc(c(c4)Cl)O
COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)C(\F)=C\CN(C)C
Oc1ccc(\C=C2\Oc3ccccc3C2=O)cc1O
[H][C@@]12CS[C@H](CCCCC(=O)NCCNC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@@H](NC(=O)C(CCCCCCCCn3cc(C[C@H](NC(C)=O)C(=O)N[C@@H](Cc4ccccc4)C(=O)N[C@@H](Cc4c[nH]c5ccccc45)C(=O)N[C@@H](Cc4ccccc4)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O)nn3)NC(=O)CCCc3cn(CCCCCCCCC(NC(C)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc4cnc[nH]4)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)CC)C(N)=O)nn3)C(C)C)[C@]1([H])NC(=O)N2 |r|
Clc1ccc(cc1)-c1ccc(o1)-c1nccn1-c1ccc(cc1)N1CCNCC1
c1cc2c(c(c1)F)c3nc(nn3c(n2)Cc4ccc5c(c4)OCO5)N
Nc1nc2c3ccc(N)cc3nc(Cc3ccc4OCOc4c3)n2n1
OCCCNc1ccc2c3ncnn3c(nc2c1)-c1ccc2OCOc2c1
c1cc2c(cc1Cc3nc4cc(ccc4c5n3nc(n5)N)NCCO)OCO2
CN1CCN(CC1)c1cc(F)c2c3nc(N)nn3c(Cc3ccc4OCOc4c3)nc2c1
CC1OC(=O)c2cc(O)c(O)c(O)c12
CC(C)CCCC1(C)CCc2cc(cc(Br)c2O1)S(N)(=O)=O
CC(C)CCCC1(C)CCc2cc(cc(F)c2O1)S(N)(=O)=O
CC(C)CCCC1(C)CCc2cc(c(C)c(C)c2O1)S(N)(=O)=O
CC(C)CCCC1(C)CCc2cc(N)ccc2O1
CC(C)CCCC1(C)CCc2cc(O)cc(C)c2N1
CC(C)CCCC1(C)CCc2ccc(O)c(O)c2O1
CC(C)CCCC1(C)CCc2c(O)cccc2O1
CC(C)CCCC1(C)CCc2cc(O)cc(Br)c2O1
CC(C)CCCC1(C)CCc2cc(O)cc(F)c2O1
COc1cc(O)cc2CCC(C)(CCCC(C)C)Oc12
CC(C)CCCC1(C)CCc2cc(O)cc(O)c2O1
CC(C)CCCC1(C)CCc2cc(O)cc(c2O1)C(F)(F)F
CC(C)CCCC1(C)CC(=O)c2cc(O)ccc2O1
CC(C)CCCC1(C)CC(=O)c2cc(O)cc(C)c2O1
CC(C)CCCC1(C)CC(=O)c2cc(O)c(C)c(C)c2O1
CC(C)CCCC1(C)CCc2cc(O)ccc2O1
CC(C)CCCC1(C)CCc2cc(O)cc(C)c2O1
COc1cc2CCC(C)(CCCC(C)C)Oc2c(C)c1C
CC(C)CCCC1(C)CCc2cc(O)c(C)c(C)c2O1
CC(C)CCC[C@]1(C)CCc2cc(O)c(C)c(C)c2O1 |r|
Cc1[nH]nc2sc(C(N)=O)c(NC(=O)Nc3ccccc3)c12
Cc1n[nH]c2sc(cc12)C(=O)NCc1ccccc1
CCCCNC(=O)c1cc2c(C)n[nH]c2s1
Cc1[nH]nc2sc(C(N)=O)c(NC(=O)c3ccccc3Cl)c12
Cc1n[nH]c2sc(cc12)C(=O)NC1CCCCC1
O=C(NC1CCCCC1)c1cc2c(n[nH]c2s1)-c1ccccc1
COc1ccc(CNC(=O)c2cc3c(n[nH]c3s2)-c2ccccc2)cc1
O=C(NCCc1ccccc1)c1cc2c(n[nH]c2s1)-c1ccccc1
Cc1n[nH]c2sc(cc12)C(N)=O
Cc1[nH]nc2sc(C(N)=O)c(NC(=O)c3cccc(Cl)c3)c12
CCCCN(C)C(=O)c1cc2c(n[nH]c2s1)-c1ccccc1
Cc1[nH]nc2sc(C(N)=O)c(NC(=O)c3ccc(Cl)cc3)c12
COC(=O)c1cc2c(Nc3ccccc3)[nH]nc2s1
COC(=O)C(=O)Nc1c(sc2n[nH]c(C)c12)C(N)=O
O=C(NCc1ccccc1)c1cc2c(n[nH]c2s1)-c1ccccc1
CCCCN(C)C(=O)c1cc2c(C)n[nH]c2s1
Cc1[nH]nc2sc(C(N)=O)c(NC(=O)COc3ccccc3)c12
Cc1[nH]nc2sc(C(N)=O)c(NC(=O)c3cccs3)c12
CN1CCN(CC1)C(=O)c1cc2c(n[nH]c2s1)-c1ccccc1
COC(=O)c1cc2c(CN3CCCCC3)n[nH]c2s1
COC(=O)c1cc2c(C)n[nH]c2s1
CC(=O)Nc1c(sc2n[nH]c(C)c12)C(N)=O
CCn1nc(C#Cc2cc(ccc2C)C(=O)Nc2ccc(CN3CCN(C)CC3)c(c2)C(F)(F)F)c2c(N)ncnc12
Cc1cc(c(cc1Sc2cnc(s2)NC(=O)c3ccc(cc3)CN[C@@H](C)C(C)(C)C)C(=O)N4CCN(CC4)C(=O)C)OC
CNc1nccc(n1)-c1ccc(s1)C(=O)N[C@H](CN)Cc1ccc(Cl)cc1Cl
NC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(C[C@@H]1F)c1ccc(cn1)C#N |r|
CNc1ncc2cc(ccc2n1)-c1cc(ccc1C)C(=O)Nc1cc(ccc1OC1CCN(C)CC1)C(F)(F)F
Cc1ccc(cc1-c1ccc2nc(NCCN3CCOCC3)ncc2c1)C(=O)Nc1cccc(c1)C(F)(F)F
Cc1cc(C)cc(SC2=C(Cl)C(=O)c3[nH]ncc3C2=O)c1 |c:8|
FC(F)(F)c1ccc(NC2=C(Cl)C(=O)c3[nH]ncc3C2=O)cc1 |c:9|
Fc1ccccc1NC1=C(Cl)C(=O)c2[nH]ncc2C1=O |c:9|
CCOc1ccc(NC2=C(Cl)C(=O)c3[nH]ncc3C2=O)cc1 |c:8|
ClC1=C(Sc2ccc(Cl)c(Cl)c2)C(=O)c2cn[nH]c2C1=O |c:1|
Nc1ccc(N)c2[nH]ncc12
Fc1ccc(NC2=C(Cl)C(=O)c3[nH]ncc3C2=O)c(F)c1 |c:6|
ClC1=C(Nc2cccc(Br)c2)C(=O)c2cn[nH]c2C1=O |c:1|
Fc1cc(F)cc(NC2=C(Cl)C(=O)c3[nH]ncc3C2=O)c1 |c:8|
COC(=O)c1c(S)c2sc(=S)sc2c(S)c1C(=O)OC
Fc1cccc(NC2=C(Cl)C(=O)c3[nH]ncc3C2=O)c1 |c:7|
Fc1ccc(NC2=C(Cl)C(=O)c3[nH]ncc3C2=O)cc1 |c:6|
COc1cc(cc(OC)c1OC)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12 |t:13|
COc1cc(Nc2c(cnc3cc(C#CCCN4CCN(C)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)-[#6@@H](-[#6])-[#8])-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](-[#8])=O
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-c1ccc(cc1)-[#7](-[#6]-[#6](=O)-[#7]C([#6])([#6])[#6])-[#6](=O)-[#6]-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-c1ccc(-[#6]\[#7]=[#6](\[#7])-[#7])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)-[#6@@H](-[#6])-[#8])-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1
C[C@@H](O)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)CNC(C)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |wU:44.44,7.14,1.1,45.47,65.67,25.33,18.17,wD:3.3,51.51,(15.5,-25.05,;14.13,-24.34,;12.87,-25.16,;14.06,-22.8,;12.7,-22.08,;11.39,-22.9,;11.45,-24.42,;10.02,-22.18,;9.96,-20.64,;11.25,-19.81,;11.18,-18.27,;12.48,-17.45,;12.4,-15.91,;13.75,-15.09,;11.07,-15.21,;8.74,-23.03,;7.37,-22.32,;6.07,-23.16,;7.3,-20.78,;8.51,-19.83,;7.96,-18.38,;6.44,-18.46,;6.01,-19.94,;4.56,-20.48,;4.31,-22,;3.37,-19.49,;3.63,-17.97,;5.08,-17.43,;5.34,-15.9,;6.79,-15.37,;7.05,-13.84,;8.49,-13.3,;5.85,-12.85,;1.92,-20.03,;.73,-19.05,;.99,-17.53,;-.72,-19.58,;-1.91,-18.6,;-3.36,-19.14,;-3.61,-20.67,;-4.55,-18.15,;15.37,-21.97,;15.29,-20.43,;16.74,-22.66,;18.03,-21.82,;17.96,-20.28,;16.59,-19.57,;19.29,-19.45,;19.4,-22.53,;19.48,-24.07,;20.71,-21.71,;22.06,-22.43,;22.13,-23.97,;23.32,-24.95,;24.78,-24.56,;25.63,-25.85,;24.63,-27.02,;24.86,-28.51,;23.67,-29.46,;22.27,-28.9,;22.05,-27.41,;23.23,-26.46,;23.38,-21.62,;23.31,-20.07,;24.75,-22.31,;26.04,-21.46,;25.98,-19.94,;27.26,-19.11,;28.63,-19.81,;29.92,-18.99,;29.86,-17.45,;28.49,-16.75,;27.19,-17.57,;27.4,-22.19,;28.72,-21.37,;27.48,-23.73,)|
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-2-[#6]-[#6]-[#6]-[#7]-2-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1
CC(C)[C@H](NC(=O)c1ccc(NC(=O)CCCCNC(N)=N)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1
[#6]-[#6]-[#6]-[#6]-[#6]-c1ccc(-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-c2ccccc2)-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-c2ccc(-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-3-[#6]-[#6]-[#6]-[#7]-3-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)cc2)-[#6](-[#6])-[#6])cc1
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@@H]-2-[#6]-[#6]-[#6]-[#7]-2-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-2-[#6]-[#6]-[#6]-[#7]-2-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-[#6]-[#6]-[#8]-c1cccc(-[#7]-[#6](-[#6])=O)c1
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-c1ccc(cc1)-[#7](-[#6]-[#6](=O)-[#7]-[#6]-c1ccccc1)-[#6](=O)-[#6]-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-c1ccc(cc1)\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1
C[C@@H](O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCN=C(N)N)NC(=O)CNC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |wU:3.3,1.1,45.47,61.62,11.18,29.37,22.21,wD:51.51,7.7,(18.13,-19.89,;19.5,-20.61,;20.81,-19.77,;19.56,-22.15,;18.28,-22.97,;16.92,-22.26,;16.84,-20.72,;15.61,-23.1,;14.24,-22.38,;12.95,-23.22,;13.01,-24.75,;11.58,-22.51,;11.5,-20.97,;12.8,-20.13,;12.73,-18.58,;14.04,-17.76,;13.98,-16.22,;15.28,-15.41,;12.6,-15.53,;10.27,-23.34,;8.91,-22.6,;7.61,-23.43,;8.85,-21.06,;10.05,-20.1,;9.51,-18.65,;7.99,-18.73,;7.55,-20.22,;6.11,-20.75,;5.86,-22.27,;4.92,-19.78,;5.19,-18.26,;6.63,-17.72,;6.88,-16.2,;8.32,-15.67,;8.58,-14.14,;10.02,-13.6,;7.39,-13.16,;3.48,-20.31,;2.3,-19.34,;2.55,-17.82,;.86,-19.87,;-.33,-18.9,;-1.77,-19.43,;-2.96,-18.46,;-2.03,-20.95,;15.68,-24.64,;17.05,-25.34,;14.38,-25.47,;20.95,-22.85,;21.01,-24.4,;22.26,-22.03,;23.63,-22.72,;23.7,-24.25,;25.06,-24.96,;26.43,-24.26,;27.5,-25.36,;26.8,-26.73,;25.28,-26.5,;24.93,-21.9,;24.87,-20.36,;26.3,-22.61,;27.59,-21.79,;27.53,-20.26,;28.84,-19.42,;30.21,-20.12,;31.5,-19.3,;31.43,-17.76,;30.06,-17.06,;28.76,-17.89,;28.96,-22.51,;30.25,-21.69,;29.04,-24.05,)|
[#6]-[#6@@H](-[#8])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](-[#8])=O
[#6]-[#6@@H](-[#8])-[#6@H](-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#8])=O)-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](-[#8])=O
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1
[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](-[#6])=O)cc1)-[#6](-[#6])-[#6]
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-2-[#6]-[#6]-[#6]-[#7]-2-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-[#6]-c1ccc2ccccc2c1
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-2-[#6]-[#6]-[#6]-[#7]-2-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-[#6]-c1cccc2ccccc12
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-c1ccc(-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-2-[#6]-[#6]-[#6]-[#7]-2-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#6](-[#6]-c2ccccc2)-[#6]-[#6]-1
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](-[#6])=O)cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-2-[#6]-[#6]-[#6]-[#7]-2-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#6]-[#6]-[#6]-1
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](-[#6])=O)cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-[#6]-c1ccc2ccccc2c1
[#6]-[#6]-[#6]-[#6]-[#6]-c1ccc(-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-c2ccccc2)-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-c2ccc(-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](-[#6])=O)cc2)-[#6](-[#6])-[#6])cc1
[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-2-[#6]-[#6]-[#6]-[#7]-2-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)cc1)-[#6](-[#6])-[#6]
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](-[#6])=O)cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-[#6]-c1cccc2ccccc12
[#6]-[#6@@H](-[#8])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#16])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](-[#8])=O
[#6]-[#6@@H](-[#8])-[#6@H](-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](-[#8])=O
CC(C)[C@H](NC(=O)c1ccc(NC(=O)[C@H](C)NC(=O)[C@@H]2CCCN2C(=O)[C@H](C)NC(=O)CNC(C)=O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-c1ccc(-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-2-[#6]-[#6]-[#6]-[#7]-2-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](-[#6])=O)cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2cccc3[nH]nc(N)c23)c1
CNC(=O)Nc1ccc(CNc2ncsc2C(=O)Nc2ccc3OC(F)(F)Oc3c2)cn1
CNC(=O)Nc1ccc(CNc2c(cnn2C)C(=O)Nc2ccc3OC(F)(F)C(F)(F)Oc3c2)cn1
CNC(=O)Nc1ccc(CNc2c(cnn2C)C(=O)Nc2ccc(SC(F)(F)F)cc2)cn1
CCNC(=O)Nc1ccc(CNc2ncsc2C(=O)Nc2ccc3OC(F)(F)Oc3c2)cn1
c1c(cc(c2c1CN(C2=O)C3CCN(CC3)C4CCC(CC4)(F)F)C(=O)N)F
COc1cc(ccc1N)-c1ccc2c(Nc3ccc(cc3NC2=O)C(C)(C)C(=O)Nc2ccc(cc2)N2CCOCC2)c1
COc1cc(ccc1N)-c1ccc2c(Nc3ccc(CC(=O)Nc4ccc(cc4)N4CCOCC4)cc3NC2=O)c1
COc1ccc2cc(ccc2c1)-c1c(nc(-c2ccc(cc2C)S(C)=O)n1C)-c1ccncc1
CN(C)C(=O)Oc1cccc(NC(=O)C2(CN)CCN(CC2)c2ncnc3[nH]cc(C)c23)c1
CN(C)CC1(CCN(CC1)c1ncnc2[nH]c(C)c(C)c12)C(=O)Nc1cccc(OC(=O)N(C)C)c1
COC(=O)c1cccc(NC(=O)C2(CN(C)C)CCN(CC2)c2ncnc3[nH]c(C)c(C)c23)c1
CCN(CC)CCOc1ccc(Nc2cc(NC(=O)Nc3c(Cl)cccc3Cl)ncn2)cc1
Cc1[nH]ncc1-c1ccccc1
c1n[nH]cc1-c1ccccc1
CN1CCN(CC1)c1cc2cc(-c3ccccc3)c(nc2cn1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
CN1CC(C1)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
CN(C)CCN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
OCCN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)N1CCn2cnnc2C1
CN(C)CC(=O)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
CN(C)C(=O)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
CS(=O)(=O)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
CC(=O)N1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)-n1ccnc1
CN(C)C1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
O[C@@H]1CN(CCN1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1 |r|
CN(C)CCNc1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
C[C@H]1CN([C@H](C)CN1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1 |r|
CN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
C[C@H]1CN(CCN1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1 |r|
C[C@@H]1CN(CCN1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1 |r|
C[C@H]1CN(C[C@@H](C)N1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1 |r|
C[C@H]1CN(C[C@@H](C)O1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1 |r|
OC1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)N1CCOCC1
C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2nc(ncc2cc1-c1ccccc1)N1CCCCC1
FC1(F)CCN(C1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
CN1CCN(CC1)c1nccc2cc(-c3ccccc3)c(nc12)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
CN1CCN(CC1)c1nccc2nc(-c3ccc(CN4CCC(CC4)c4nnc([nH]4)-c4ccccn4)cc3)c(cc12)-c1ccccc1
O=S1(=O)CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
O=C1NCCc2nc(-c3ccc(CN4CCC(CC4)c4nnc([nH]4)-c4ccccn4)cc3)c(cc12)-c1ccccc1
Nc1ccc(cn1)-c1nnc([nH]1)C1CCN(Cc2ccc(cc2)-c2nc3nc(ccc3nc2-c2ccccc2)N2CCN(CCO)CC2)CC1
CN1CCN(CC1)c1ccc2nc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccc(N)nc2)cc1
CN(C)CCN1CCN(CC1)c1ccc2nc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nc(n[nH]2)-c2ncccn2)cc1
OCCN1CCN(CC1)c1ccc2nc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nc(n[nH]2)-c2ncccn2)cc1
CN1CCN(CC1)c1ccc2nc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nc(n[nH]2)-c2ncccn2)cc1
CN(C)CCN1CCN(CC1)c1ccc2nc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
OCCN1CCN(CC1)c1ccc2nc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
CN1CCN(CC1)c1ccc2nc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
CN(C)CCN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2cc[n+]([O-])cc2)cc1
OCCN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2cc[n+]([O-])cc2)cc1
COc1ccc(cn1)-c1nnc([nH]1)C1CCN(Cc2ccc(cc2)-c2nc3cc[nH]c(=O)c3cc2-c2ccccc2)CC1
O=c1[nH]ccc2nc(-c3ccc(CN4CCC(CC4)c4nnc([nH]4)-c4cnccn4)cc3)c(cc12)-c1ccccc1
Nc1ccc(cn1)-c1nnc([nH]1)C1CCN(Cc2ccc(cc2)-c2nc3cc[nH]c(=O)c3cc2-c2ccccc2)CC1
O=c1ccc(c[nH]1)-c1nnc([nH]1)C1CCN(Cc2ccc(cc2)-c2nc3cc[nH]c(=O)c3cc2-c2ccccc2)CC1
O=c1[nH]ccc2nc(-c3ccc(CN4CCC(CC4)c4nc(n[nH]4)-c4ncccn4)cc3)c(cc12)-c1ccccc1
CN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2cc[n+]([O-])cc2)cc1
CN(C)CCN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccc(=O)[nH]c2)cc1
OCCN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccc(=O)[nH]c2)cc1
CN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccc(=O)[nH]c2)cc1
CN(C)CCN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccc(N)nc2)cc1
Nc1ccc(cn1)-c1nnc([nH]1)C1CCN(Cc2ccc(cc2)-c2nc3nc(ncc3cc2-c2ccccc2)N2CCN(CCO)CC2)CC1
CN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccc(N)nc2)cc1
CN(C)CCN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nc(n[nH]2)-c2ncccn2)cc1
OCCN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nc(n[nH]2)-c2ncccn2)cc1
CN1CCN(CC1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nc(n[nH]2)-c2ncccn2)cc1
CN1CCN(CC1)c1ccc2nc(-c3ccc(CN4CCC(CC4)c4nnc([nH]4)-c4ccccn4)cc3)c(nc2n1)-c1ccccc1
CCN1CCN(CC\C=C\c2ccc3c(Nc4ccc(Sc5nccn5C)c(Cl)c4)c(cnc3c2)C#N)CC1
CN(C)CCOc1cc(ccc1NC(=O)C1COc2ccc(F)cc2C1)-c1cn[nH]c1
COc1ccc2OCC(Cc2c1)C(=O)Nc1ccc(cc1OCCN(C)C)-c1cn[nH]c1
CN(C)CCOc1cc(ccc1NC(=O)C1COc2ccccc2C1)-c1cn[nH]c1
COc1ccc2OCC(Cc2c1)c1nc2cc(cc(F)c2[nH]1)-c1ccnc(N)n1
NC(=N)SCCCn1c(=O)c2c(n3c(cc4ccccc34)c3cccc4ccn2c34)c1=O
Nc1nnc2c3cc(-c4ccccc4)c(nc3ccn12)-c1ccc(CN2CCC(CC2)n2cnc(c2)-c2ccccn2)cc1
OCCNCc1nnc2c3cc(-c4ccccc4)c(nc3ccn12)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
CN1CCN(Cc2nnc3c4cc(-c5ccccc5)c(nc4ccn23)-c2ccc(CN3CCC(CC3)c3nnc([nH]3)-c3ccccn3)cc2)CC1
ClCc1nnc2c3cc(-c4ccccc4)c(nc3ccn12)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Cc1nnc2c3cc(-c4ccccc4)c(nc3ccn12)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2ccn3cnnc3c2cc1-c1ccccc1
NC(=O)Nc1nnc2c3cc(-c4ccccc4)c(nc3ccn12)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
S=c1[nH]nc2c3cc(-c4ccccc4)c(nc3ccn12)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
O=c1[nH]nc2c3cc(-c4ccccc4)c(nc3ccn12)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Nc1nnc2c3cc(-c4ccccc4)c(nc3ccn12)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1
Cn1c2nc(Nc3ccc4[nH]ccc4c3)ncc2cc(c1=O)S(=O)(=O)c1ccc(F)cc1F
NCC(NC(=O)c1ccc(s1)-c1ccnc2[nH]ccc12)c1ccccc1
NCC(NC(=O)c1ccc(s1)-c1c[nH]c2ncccc12)c1ccccc1
NCC(NC(=O)c1cc(cs1)-c1ccnc2[nH]ccc12)c1ccccc1
NCC(NC(=O)c1cc(cs1)-c1c[nH]c2ncccc12)c1ccccc1
NCC(NCc1ccc(s1)-c1ccnc2[nH]ccc12)c1ccccc1
NCC(CNc1ccc(s1)-c1ccnc2[nH]ccc12)c1ccccc1
NCC(C(=O)Nc1ccc(s1)-c1ccnc2[nH]ccc12)c1ccccc1
NCC(C(=O)Nc1cc(Br)c(s1)-c1ccnc2[nH]ccc12)c1ccccc1
Cc1cc(sc1-c1ccnc2[nH]ccc12)C(=O)NC(CN)c1ccccc1
NCC(NC(=O)c1cc(C2CC2)c(s1)-c1ccnc2[nH]ccc12)c1ccccc1
NCC(NC(=O)c1cc(c(s1)-c1ccnc2[nH]ccc12)-c1ccccc1)c1ccccc1
NCC(NC(=O)c1cc(c(s1)-c1ccnc2[nH]ccc12)-c1cccnc1)c1ccccc1
NCC(NC(=O)c1cc(-c2cn[nH]c2)c(s1)-c1ccnc2[nH]ccc12)c1ccccc1
NCCNC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12
NC(CNC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12)c1ccccc1
CNCC(NC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12)c1ccccc1
CN(C)CC(NC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12)c1ccccc1
NCCC(NC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12)c1ccccc1
NCCCC(NC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12)c1ccccc1
CNCC(Cc1ccccc1)NC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12
CCNCC(Cc1ccccc1)NC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12
CC(C)NCC(Cc1ccccc1)NC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12
NC[C@H](Cc1ccncc1)NC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12 |r|
NC[C@H](Cc1ccccc1F)NC(=O)c1cc(Br)c(s1)-c1ccnc2[nH]ccc12 |r|
Oc1cc(CNC=C2C(=O)NC(=O)c3ccc(I)cc23)ccc1-c1ccoc1 |w:6.5|
COc1c(NC(=O)Nc2ccc(-c3ccc(CN4CCOCC4)nc3)c3ccccc23)cc(cc1NS(C)(=O)=O)C(C)(C)C
Cc1ccc(cc1)-c1ncc(OCC2CCNCC2)cc1-c1ccc(cc1)C#N
[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,)|
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,)|
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,)|
CN1CCN(CC1)c2ccc(c(c2)NC3CCOCC3)C(=O)Nc4c5cc(ccc5[nH]n4)Cc6cc(cc(c6)F)F
Cn1ncc(Br)c1-c1csc(c1)C(=O)NC1(CCNCC1)c1ccc(F)cc1
Cn1ncc(Cl)c1-c1csc(c1)C(=O)NC1(CCNCC1)c1ccc(F)cc1
Cn1nccc1-c1csc(c1)C(=O)NC1(CCNCC1)c1ccc(F)cc1
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@H](CN)Cc1ccc(F)c(F)c1 |r,wD:16.18,(2.37,-.54,;3.52,.49,;3.36,2.02,;4.77,2.65,;5.8,1.51,;7.33,1.67,;5.03,.17,;5.65,-1.23,;7.16,-1.55,;7.32,-3.09,;5.91,-3.71,;4.88,-2.57,;3.35,-2.73,;8.65,-3.86,;9.99,-3.09,;8.65,-5.4,;9.99,-6.17,;11.32,-5.4,;12.65,-6.17,;9.99,-7.71,;11.32,-8.48,;12.65,-7.71,;13.99,-8.48,;13.99,-10.02,;15.32,-10.79,;12.65,-10.79,;12.65,-12.33,;11.32,-10.02,)|
Cn1ncc(Br)c1-c1ccc(cc1)C(=O)NC1(CCNCC1)c1ccc(Cl)c(Cl)c1
Cn1ncc(Cl)c1-c1ccc(cc1)C(=O)NC1(CCNCC1)c1ccc(Cl)c(Cl)c1
Cn1ncc(Cl)c1-c1c(Cl)c(C(=O)NC2(CCNCC2)c2ccc(Cl)c(Cl)c2)n(C)c1Cl |(.16,9.88,;-1.04,9.6,;-2.21,10.59,;-3.53,9.79,;-3.16,8.29,;-3.96,7.35,;-1.64,8.19,;-.74,6.95,;-1.21,5.48,;-2.38,5.09,;.04,4.6,;.04,3.06,;1.1,2.44,;-1.3,2.29,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;-2.63,-.02,;-3.98,.71,;-5.3,-.09,;-5.26,-1.63,;-6.31,-2.27,;-3.91,-2.36,;-3.88,-3.6,;-2.59,-1.56,;1.28,5.49,;2.45,5.1,;.8,6.95,;1.53,7.95,)|
Cn1cc(cc1C(=O)NC1(CCNCC1)c1ccc(Cl)c(Cl)c1)-c1c(Br)cnn1C
Cn1ncc(Cl)c1-c1oc(cc1Br)C(=O)NC1(CCNCC1)c1ccc(Cl)c(Cl)c1 |(3.87,7,;3.23,8.06,;3.82,9.48,;2.64,10.48,;1.33,9.67,;.19,10.14,;1.71,8.2,;.8,6.95,;1.28,5.49,;.04,4.6,;-1.21,5.48,;-.74,6.95,;-1.46,7.94,;.04,3.06,;1.1,2.44,;-1.3,2.29,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;-2.63,-.02,;-3.98,.71,;-5.3,-.09,;-5.26,-1.63,;-6.31,-2.27,;-3.91,-2.36,;-3.88,-3.6,;-2.59,-1.56,)|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)NC1(CCNCC1)c1ccc(Cl)c(Cl)c1 |(.16,9.88,;-1.04,9.6,;-2.21,10.59,;-3.53,9.79,;-3.16,8.29,;-3.96,7.35,;-1.64,8.19,;-.74,6.95,;-1.21,5.48,;.04,4.6,;1.28,5.49,;.8,6.95,;1.53,7.95,;.04,3.06,;1.1,2.44,;-1.3,2.29,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;-2.63,-.02,;-2.59,-1.56,;-3.91,-2.36,;-5.26,-1.63,;-6.31,-2.27,;-5.3,-.09,;-6.38,.5,;-3.98,.71,)|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)NC1(CCNCC1)c1ccc(F)cc1 |(.16,9.88,;-1.04,9.6,;-2.21,10.59,;-3.53,9.79,;-3.16,8.29,;-3.96,7.35,;-1.64,8.19,;-.74,6.95,;-1.21,5.48,;.04,4.6,;1.28,5.49,;.8,6.95,;1.53,7.95,;.04,3.06,;1.1,2.44,;-1.3,2.29,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;-1.33,-.77,;-2.63,-.02,;-2.59,-1.56,;-3.91,-2.36,;-5.26,-1.63,;-6.31,-2.27,;-5.3,-.09,;-3.98,.71,)|
Cn1ncc(Br)c1-c1coc(c1)C(=O)NC1(CCNCC1)c1ccc(Cl)c(Cl)c1
Cn1ncc(Br)c1-c1coc(c1)C(=O)NC1(CCNCC1)c1ccc(F)cc1
Cn1ncc(Cl)c1-c1coc(c1)C(=O)NC1(CCNCC1)c1ccc(F)cc1
Cn1nccc1-c1csc(c1)C(=O)NC1(CCNCC1)c1ccc(Cl)c(Cl)c1
CN1C(=O)COc2c1cnc1ccc(Sc3nnc4c(F)cc(cn34)-c3cnn(C)c3)cc21
CCCCCCCCCCCCCCCCCC(=O)OCC(CO)O[C@@H]1O[C@H](CS(O)(=O)=O)[C@@H](O)[C@H](O)[C@H]1O |r|
CCCCCCCCCCCCCCCCCCOP([O-])(=O)OC1CC[N+](C)(C)CC1
CCOC(=O)c1cnn2c(ccnc12)-c1cccc(NC(=O)c2cccc(c2)C(F)(F)F)c1
O=C1COc2ccc(cc2N1)-c1cc(cc(n1)-c1ccc2oc(=O)[nH]c2c1)-c1ccccc1
COc1cc(cc(OC)c1OC)-c1nc(c[nH]c1=O)-c1c[nH]c2ccccc12
Cn1cc(C[C@H](N)COc2cncc(\C=C\c3ccncc3)c2)c2ccccc12 |r|
C(Oc1cncc(\C=C\c2ccncc2)c1)[C@@H]1CCN1 |r|
Brc1ccc(\C=C\CNCCOc2cncc(\C=C\c3ccncc3)c2)cc1
CN(C)[C@H](COc1cncc(\C=C\c2ccncc2)c1)Cc1c[nH]c2ccccc12 |r|
Cn1cc(C(CN)Oc2cncc(\C=C\c3ccncc3)c2)c2ccccc12
COc1cc(\C=C\c2cncc(OC[C@@H](N)Cc3c[nH]c4ccccc34)c2)ccn1 |r|
N[C@H](COc1cncc(\C=C\c2ccnc(Oc3ccccc3)c2)c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(\C=C\c2ccnc(N)c2)c1)Cc1c[nH]c2ccccc12 |r|
Fc1ccc(F)c(NC2=C(Cl)C(=O)c3[nH]ncc3C2=O)c1 |c:8|
ClC1=C(Sc2cccc(Cl)c2Cl)C(=O)c2cn[nH]c2C1=O |c:1|
N[C@H](COc1cncc(c1)-c1cc2ccncc2s1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1cnc2NC(=O)Cc2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(=O)c2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2[nH]c(=O)oc2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2[nH]c(=O)sc2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2NC(=O)Cc2c1)Cc1ccccc1 |r|
N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(Cc3ccco3)c2c1)Cc1ccccc1 |r|
N[C@H](COc1cncc(c1)-c1ccc2NC(=O)\C(=C/c3ccc[nH]3)c2c1)Cc1ccccc1 |r|
CC1C(=O)Nc2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1 |r|
CCC1C(=O)Nc2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1 |r|
N[C@H](COc1cncc(c1)-c1ccc2NC(=O)Cc2c1)Cc1c[nH]c2ccccc12 |r|
CC(C)=C1C(=O)Nc2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1 |r,wU:20.22,(-12.05,2.37,;-10.54,2.69,;-9.45,1.6,;-10.07,4.16,;-10.97,5.4,;-12.51,5.4,;-10.07,6.65,;-8.6,6.17,;-7.27,6.94,;-5.93,6.17,;-5.93,4.63,;-7.27,3.86,;-8.6,4.63,;-4.6,3.86,;-4.6,2.32,;-3.27,1.55,;-1.93,2.32,;-1.93,3.86,;-.6,4.63,;.73,3.86,;2.07,4.63,;2.07,6.17,;3.4,3.86,;4.74,4.63,;4.28,6.1,;5.53,6.99,;6.77,6.07,;8.28,6.37,;9.3,5.22,;8.8,3.76,;7.29,3.46,;6.28,4.61,;-3.27,4.63,)|
N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(F)(F)c2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(C3CC3)c2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(c2c1)c1ccccc1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(c2c1)c1cccnc1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(c2c1)c1ccccn1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(c3ccc[nH]3)c2c1)Cc1c[nH]c2ccccc12 |r|
Cn1cccc1C1C(=O)Nc2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1 |r|
N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(c3c[nH]c4ccccc34)c2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(c3ncc[nH]3)c2c1)Cc1c[nH]c2ccccc12 |r|
CCc1c(C)[nH]c(C2C(=O)Nc3ccc(cc23)-c2cncc(OC[C@@H](N)Cc3c[nH]c4ccccc34)c2)c1C |r|
N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(c3ccco3)c2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2NC(=O)C(c3cccs3)c2c1)Cc1c[nH]c2ccccc12 |r|
Cc1ccc(o1)C1C(=O)Nc2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1 |r|
Cc1cc(oc1C)C1C(=O)Nc2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1 |r|
O=c1[nH]c2ccccc2n1C1CCN(Cc2ccc(cc2)-c2nc3ccc(cc3nc2-c2ccccc2)-n2cnnn2)CC1
O=c1[nH]c2ccccc2n1C1CCN(Cc2ccc(cc2)-c2nc3cc(ccc3nc2-c2ccccc2)-n2cnnn2)CC1
O=c1[nH]c2ccccc2n1C1CCN(Cc2ccc(cc2)-c2nc3ccc(Cn4cnnn4)cc3nc2-c2ccccc2)CC1
CC(C)c1nc(-c2ccccc2)c([nH]c1=O)-c1ccc(CN2CCC(CC2)n2c3ccccc3[nH]c2=O)cc1
CNc1cc(\C=C\c2cncc(OC[C@@H](N)Cc3c[nH]c4ccccc34)c2)ccn1 |r|
CCNc1cc(\C=C\c2cncc(OC[C@@H](N)Cc3c[nH]c4ccccc34)c2)ccn1 |r|
N[C@H](COc1cncc(\C=C\c2ccnc(NCc3ccccc3)c2)c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(\C=C\c2ccnc(c2)-n2ccc3ccccc23)c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](CCc1cnc(Cl)c(\C=C\c2ccncc2)c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](CNc1cnc(Cl)c(\C=C\c2ccncc2)c1)Cc1c[nH]c2ccccc12 |r|
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)Nc1cncc(\C=C\c2ccncc2)c1 |r|
N[C@@H](Cc1ccccc1)C(=O)Nc1cncc(\C=C\c2ccncc2)c1 |r|
N[C@@H](Cc1cccc2ccccc12)C(=O)Nc1cncc(\C=C\c2ccncc2)c1 |r|
N[C@H](COc1cncc(c1)-c1ccc2cnccc2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cnc(Cl)c(c1)-c1ccc2cnccc2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cnc(C#N)c(c1)-c1ccc2cnccc2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cnc(C=C)c(c1)-c1ccc2cnccc2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cnc(-c2ccco2)c(c1)-c1ccc2cnccc2c1)Cc1c[nH]c2ccccc12 |r|
CCc1ncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)cc1-c1ccc2cnccc2c1 |r|
N[C@H](COc1cc(cnc1Cl)-c1ccc2cnccc2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2cnc(F)cc2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2cnc(C=C)cc2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2cnc(cc2c1)-c1ccccc1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2cnc(cc2c1)-c1ccncc1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2cnc(N)cc2c1)Cc1c[nH]c2ccccc12 |r|
C[C@H](N)COc1cnc(Cl)c(\C=C\c2ccncc2)c1 |r|
NCCOc1cncc(\C=C\c2ccncc2)c1
CC(C)[C@H](N)COc1cncc(\C=C\c2ccncc2)c1 |r|
N[C@H](COc1cncc(\C=C\c2ccncc2)c1)Cc1ccccc1 |r|
N[C@H](COc1cncc(\C=C\c2ccncc2)c1)C(c1ccccc1)c1ccccc1 |r|
N[C@@H](CCc1ccccc1)COc1cncc(\C=C\c2ccncc2)c1 |r|
N[C@@H](COCc1ccccc1)COc1cncc(\C=C\c2ccncc2)c1 |r|
N[C@H](COc1cncc(\C=C\c2ccncc2)c1)Cc1cccc(c1)C#N |r|
N[C@H](COc1cncc(\C=C\c2ccncc2)c1)Cc1cccc2ccccc12 |r|
N[C@H](COc1cncc(\C=C\c2ccncc2)c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2cnccc2c1N)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2ccccc2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2ncccc2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2nnccc2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2c(cc[nH]c2=O)c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2c(N)nccc2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1cccc2cnccc12)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccncc1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)C(=O)Nc1ccncc1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc(CO)cc1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2[nH]ncc2c1)Cc1c[nH]c2ccccc12 |r|
Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1 |r|
N[C@H](COc1cncc(c1)-c1ccc2[nH]nc(Cl)c2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2[nH]nc(c2c1)C(F)(F)F)Cc1c[nH]c2ccccc12 |r|
CCc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1 |r|
N[C@H](COc1cncc(c1)-c1ccc2[nH]nc(N)c2c1)Cc1c[nH]c2ccccc12 |r|
CN(C)c1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1 |r|
N[C@H](COc1cncc(c1)-c1ccc2[nH]nc(-c3ccccc3)c2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2[nH]nc(-c3cccs3)c2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2[nH]nc(C3CC3)c2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2[nH]nc(-c3nccs3)c2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2[nH]nc(-c3ccc[nH]3)c2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2[nH]nc(N3CCOCC3)c2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc2[nH]nc(C=O)c2c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1cc2cn[nH]c2cc1[N+]([O-])=O)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1cc2cn[nH]c2cc1N)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1cc2c(Cl)n[nH]c2cc1N)Cc1c[nH]c2ccccc12 |r|
Cc1n[nH]c2cnc(cc12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1 |r|
N[C@H](COc1cncc(c1)-c1cc2c(Cl)n[nH]c2cn1)Cc1ccccc1 |r|
N[C@H](COc1cncc(c1)-c1cc2c(C=C)n[nH]c2cn1)Cc1ccccc1 |r|
N[C@H](COc1cncc(c1)-c1cc2c(n[nH]c2cn1)-c1ccco1)Cc1ccccc1 |r|
Cc1n[nH]c2cnc(cc12)-c1cncc(OC[C@@H](N)Cc2ccccc2)c1 |r|
Cc1n[nH]c2cnc(cc12)-c1cncc(OC[C@@H](N)Cc2cccc(F)c2)c1 |r|
Cc1n[nH]c2cnc(cc12)-c1cncc(OC[C@@H](N)Cc2c(C)cc(C)cc2C)c1 |r|
Cc1n[nH]c2cnc(cc12)-c1cncc(OC[C@@H](N)Cc2ccc(cc2)C(F)(F)F)c1 |r|
Cc1n[nH]c2cnc(cc12)-c1cncc(OC[C@@H](N)Cc2cccc3OC(F)(F)Oc23)c1 |r|
Cc1n[nH]c2cnc(cc12)-c1cncc(OC[C@@H](N)Cc2cccc(OCCN3CCOCC3)c2)c1 |r|
Cc1n[nH]c2cnc(cc12)-c1cncc(OC[C@@H](N)Cc2cccc(OCC3CCNCC3)c2)c1 |r|
Cc1n[nH]c2cnc(cc12)-c1cncc(OC[C@@H](N)Cc2cccc(OCC3CCCCC3)c2)c1 |r|
Cc1n[nH]c2cnc(cc12)-c1cncc(OC[C@@H](N)Cc2cccc(OCCN)c2)c1 |r|
Cc1n[nH]c2cnc(cc12)-c1cncc(OC[C@@H](N)Cc2c(F)cccc2F)c1 |r|
Cc1n[nH]c2cnc(cc12)-c1cncc(OC[C@@H](N)Cc2ccc(F)c(F)c2F)c1 |r|
Cc1n[nH]c2cnc(cc12)-c1cncc(OC[C@@H](N)Cc2ccc(Br)cc2)c1 |r|
Cc1n[nH]c2cnc(cc12)-c1cncc(OC[C@@H](N)Cc2cc(F)ccc2C)c1 |r|
Cc1n[nH]c2cnc(cc12)-c1cncc(OC[C@@H](N)Cc2ccc(F)c(C)c2)c1 |r|
Cc1n[nH]c2cnc(cc12)-c1cncc(OC[C@@H](N)Cc2ccc(F)cc2C)c1 |r|
N[C@H](COc1cncc(CCc2ccncc2)c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(NC(=O)c2ccncc2)c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(Nc2cccnc2)c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc(cc1)C(O)=O)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1cccc(CC(N)=O)c1)Cc1c[nH]c2ccccc12 |r|
CC(=O)Nc1ccc(cc1)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1 |r|
N[C@H](COc1cncc(c1)-c1ccc(NC(=O)Nc2ccccc2)cn1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1ccc(N)c(c1)C(=O)c1cccc(Cl)c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1cccc2c(cccc12)C(N)=O)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(c1)-c1cccc(Nc2ncccn2)c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc(Nc2cccnc2)c1)Cc1ccccc1 |r|
N[C@H](COc1cnc2ccc(cc2c1)-c1ccncc1)Cc1c[nH]c2ccccc12 |r|
N[C@H](COc1cncc2nc(ccc12)-c1ccncc1)Cc1c[nH]c2ccccc12 |r|
N[C@H](CNc1cncc(Oc2cccc3cnccc23)c1)Cc1c[nH]c2ccccc12 |r|
N[C@H](CNc1cncc(Nc2cccc3cnccc23)c1)Cc1c[nH]c2ccccc12 |r|
COCCOc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1NC(=O)[C@@H]1CCCN1C(=O)C=C |r|
COCCOc1cc2ncnc(Nc3ccc(F)c(Cl)c3F)c2cc1NC(=O)[C@@H]1CCCN1C(=O)C=C |r|
O[C@@H]1[C@@H](OP(O)(O)=O)C(OP(O)(O)=O)[C@H](C(=O)C1OP(O)(O)=O)P(O)(O)O |r|
c1cc(c(c(c1OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O
Cc1[nH]n(C(=O)c2ccc(Cl)cc2)c(=O)c1N=Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1 |w:16.17|
Cc1[nH]n(C(=O)c2ccccc2)c(=O)c1N=Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1 |w:15.16|
Cc1[nH]n(C(=O)c2ccc(cc2)C(C)(C)C)c(=O)c1N=Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1 |w:19.20|
Cc1[nH]n(C(=O)c2ccc(N)cc2)c(=O)c1N=Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1 |w:16.17|
Cc1[nH]n(C(=O)c2ccc(O)cc2)c(=O)c1N=Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1 |w:16.17|
CN(c1ncccn1)S(=O)(=O)c1ccc(cc1)N=Nc1c(C)[nH]n(C(=O)c2ccc(Cl)cc2)c1=O |w:18.20|
Cc1nnc(NS(=O)(=O)c2ccc(NS(=O)(=O)c3ccc4ccccc4c3)cc2)s1
Nc1ccc(cc1)S(=O)(=O)Nc1nncs1
CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nncs1
CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nncs1
CC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nncs1
COCCOCCOCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nncs1
NCCn1cc(-c2cc(-c3cc4ccccc4s3)c3[nH]ncc3c2)c2nc(N)ncc12
CN(C)CCOc1ccc2Nc3c(C(N)=O)c(nn3CCc2c1)-c1ccc(Oc2ccccc2)cc1
NC(=O)c1c(N)c([nH]c1-c1ccc(Oc2ccccc2)cc1)C(=O)c1c(F)cccc1F
CC1(C)C(=O)N([C@H]2CCc3c2cccc3O)c2nc(Nc3ccccc3)ncc12 |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2c[nH]c3ccccc23)cnc1-c1ccoc1 |r|
Cc1n[nH]c2ncc(cc12)-c1cc(OC[C@@H](N)Cc2c[nH]c3ccccc23)cnc1-c1ccoc1 |r|
Cc1n[nH]c2ccc(nc12)-c1cc(OC[C@@H](N)Cc2c[nH]c3ccccc23)cnc1-c1ccoc1 |r|
Cc1n[nH]c2ncc(nc12)-c1cc(OC[C@@H](N)Cc2c[nH]c3ccccc23)cnc1-c1ccoc1 |r|
Cc1[nH]nc2cnc(nc12)-c1cc(OC[C@@H](N)Cc2c[nH]c3ccccc23)cnc1-c1ccoc1 |r|
Cc1n[nH]c2cnc(cc12)-c1cc(OC[C@@H](N)Cc2c[nH]c3ccccc23)cnc1-c1ccoc1 |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2ccccc2)cnc1-c1cc(Cl)ccc1O |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2ccccc2)cnc1-c1cc(F)cc(F)c1O |r|
COc1ccccc1-c1ncc(OC[C@@H](N)Cc2ccccc2)cc1-c1ccc2[nH]nc(C)c2c1 |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2ccccc2)cnc1-c1ccc(O)cc1 |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2ccccc2)cnc1-c1cccc(O)c1 |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2ccccc2)cnc1-c1ccccc1O |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2ccccc2)cnc1-c1ccccc1 |r|
Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccccc2)c1 |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2c[nH]c3ccncc23)cnc1-c1ccoc1 |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2c[nH]c3cccnc23)cnc1-c1ccoc1 |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2c[nH]c3ncccc23)cnc1-c1ccoc1 |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2c[nH]c3c(F)cccc23)cnc1-c1ccoc1 |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2c[nH]c3cc(F)ccc23)cnc1-c1ccoc1 |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2c[nH]c3ccc(F)cc23)cnc1-c1ccoc1 |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2c[nH]c3ccccc23)cnc1-c1ccoc1C |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2ccccc2)cnc1-c1cc(F)ccc1O |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2ccccc2)cnc1-c1ccco1 |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2ccccc2)cnc1C#CC(C)(C)O |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2ccccc2)cnc1C#CCCO |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2ccccc2)cnc1-c1ccc[nH]1 |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2ccccc2)cnc1-c1ccsc1 |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2ccccc2)cnc1-c1cccs1 |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2ccccc2)cnc1-c1ccoc1 |r|
Cc1n[nH]c2ncc(nc12)-c1cc(OC[C@@H](N)Cc2c[nH]c3ccccc23)cnc1-c1ccoc1C |r|
Cc1n[nH]c2ccc(cc12)-c1cc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c(N)nc1-c1ccoc1C |r|
Cc1n[nH]c2ncc(cc12)-c1cc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c(N)nc1-c1ccoc1C |r|
Cc1n[nH]c2ncc(nc12)-c1cc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c(N)nc1-c1ccoc1C |r|
Cc1n[nH]c2cnc(cc12)-c1cc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c(N)nc1-c1ccoc1C |r|
Cc1n[nH]c2ncc(nc12)-c1cc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c(nc1-c1ccoc1)C#N |r|
Cc1n[nH]c2ncc(nc12)-c1cc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c(C)nc1-c1ccoc1 |r|
Cc1n[nH]c2ncc(nc12)-c1cc(OC[C@@H](N)Cc2ccccc2)c(N)nc1-c1ccoc1C |r|
CCNc1nc(-c2ccoc2)c(cc1OC[C@@H](N)Cc1ccccc1)-c1cnc2[nH]nc(C)c2n1 |r|
Cc1n[nH]c2ncc(nc12)-c1cc(OC[C@@H](N)Cc2c(Cl)[nH]c3ccccc23)c(N)nc1-c1ccoc1C |r|
Cc1n[nH]c2ncc(nc12)-c1cc(OC[C@@H](N)Cc2c([nH]c3ccccc23)C#N)c(N)nc1-c1ccoc1C |r|
Cc1n[nH]c2ncc(nc12)-c1cc(OC[C@@H](N)Cc2c([nH]c3ccccc23)C(N)=O)c(N)nc1-c1ccoc1C |r|
C[C@@H](Oc1ccc2ncc(\C=C\C(N)=O)cc2c1)c1c(Cl)ccc(F)c1Cl |r|
C[C@@H](Oc1ccc2ncccc2c1)c1c(Cl)ccc(F)c1Cl |r|
C[C@@H](Oc1ccc2ncc(cc2c1)C1CC1C(N)=O)c1c(Cl)ccc(F)c1Cl |r|
CNC(=O)c1nn(C)c-2c1CCc1cnc(NC3CCN(CC3)C(=O)C3CCN(CC3)S(C)(=O)=O)nc-21
CC(=O)N1CCC(CC1)Nc1ncc2CCc3c(nn(C)c3-c2n1)C(N)=O
Cn1nc(C(N)=O)c2CCc3cnc(NC4CCN(CC4)C(=O)c4ccccc4)nc3-c12
NC1(COCc2ccc(Cl)cc2)CCN(CC1)c1ncnc2[nH]ccc12
NC1(Cc2ccc(Cl)cc2)CCN(CC1)c1ncnc2[nH]ccc12
NC1(Cc2ccc(Cl)cc2Cl)CCN(CC1)c1ncnc2[nH]ccc12
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NCc1ccc(Cl)cc1Cl
CN(Cc1ccc(Cl)cc1)C(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12
CC(C)(C)c1ccc(CC2(N)CCN(CC2)c2ccnc3[nH]ncc23)cc1
NC1(CCN(CC1)c1ccnc2[nH]ccc12)C(=O)NCc1ccc(Cl)cc1
NC1(CCN(CC1)c1ncnc2[nH]c(=O)[nH]c12)C(=O)NCc1ccc(Cl)cc1
CCCNc1nnc(Sc2ncc(s2)[N+]([O-])=O)s1
COCCNc1nnc(Sc2ncc(s2)[N+]([O-])=O)s1
COc1ccc(CCNc2nnc(Sc3ncc(s3)[N+]([O-])=O)s2)cc1OC
CCC(C)Nc1nnc(Sc2ncc(s2)[N+]([O-])=O)s1
FC(F)(F)c1cccc(NC(=O)Nc2cccc(c2)-c2cn3ccnc3c(NCc3ccncc3)n2)c1
N[C@H](CNc1nnc(s1)-c1ccc2[nH]nc(C3CC3)c2c1)Cc1ccc(cc1)C(F)(F)F |r|
N[C@H](CNc1nnc(s1)-c1ccc2[nH]nc(-c3ccccc3)c2c1)Cc1cccc(c1)C(F)(F)F |r|
N[C@H](CNc1nnc(s1)-c1ccc2[nH]ncc2c1)Cc1cccc(c1)C(F)(F)F |r|
N[C@H](CNc1nnc(s1)-c1ccc2[nH]ncc2c1)Cc1ccc(F)cc1 |r|
N[C@H](CNc1nnc(s1)-c1ccc2[nH]ncc2c1)Cc1ccc(Cl)cc1 |r|
N[C@H](CNc1nnc(s1)-c1ccc2[nH]ncc2c1)Cc1ccc(cc1)C(F)(F)F |r|
N[C@H](CNc1nnc(s1)-c1ccc2[nH]ncc2c1)Cc1ccc(Cl)cc1Cl |r|
Cc1cc2cc(ccc2cn1)-c1nnc(NC[C@@H](N)Cc2ccc(cc2)C(F)(F)F)s1 |r|
Cc1n[nH]c2ccc(cc12)-c1nnc(NC[C@@H](N)Cc2ccc(cc2)C(F)(F)F)s1 |r|
Cc1n[nH]c2ccc(cc12)-c1nnc(NC[C@@H](N)Cc2ccc(Cl)cc2)s1 |r|
Cc1n[nH]c2ccc(cc12)-c1nnc(NC[C@@H](N)Cc2ccc(Cl)cc2Cl)s1 |r|
Cc1n[nH]c2ccc(cc12)-c1nnc(NC[C@@H](N)Cc2ccc(F)c(F)c2)s1 |r|
CCc1n[nH]c2ccc(cc12)-c1nnc(NC[C@@H](N)Cc2ccccc2)s1 |r|
Cc1n[nH]c2ccc(cc12)-c1nnc(NC[C@@H](N)Cc2ccccc2)s1 |r|
Cc1n[nH]c2ccc(cc12)-c1nnc(NC[C@H](N)Cc2ccccc2)s1 |r|
Cc1n[nH]c2ccc(cc12)-c1nnc(NC[C@@H](N)Cc2ccccc2F)s1 |r|
Cc1n[nH]c2ccc(cc12)-c1nnc(NC[C@@H](N)Cc2ccccc2Cl)s1 |r|
Cc1n[nH]c2ccc(cc12)-c1nnc(NC[C@@H](N)Cc2ccccc2C(F)(F)F)s1 |r|
Cc1n[nH]c2ccc(cc12)-c1nnc(NC[C@@H](N)Cc2cccc(F)c2)s1 |r|
Cc1n[nH]c2ccc(cc12)-c1nnc(NC[C@@H](N)Cc2cccc(Cl)c2)s1 |r|
Cc1n[nH]c2ccc(cc12)-c1nnc(NC[C@@H](N)Cc2cccc(c2)C(F)(F)F)s1 |r|
C[C@@H]1C[C@H]1C(=O)N1CCN(C[C@H]1C)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|
N[C@H](CNc1cnc(s1)-c1ccc2cnccc2c1)Cc1ccc(cc1)C(F)(F)F |r|
N[C@H](CNc1cc(no1)-c1ccc2cnccc2c1)Cc1ccc(cc1)C(F)(F)F |r|
N[C@H](CCc1nc(no1)-c1ccc2cnccc2c1)Cc1ccc(cc1)C(F)(F)F |r|
N[C@H](CNc1ncc(s1)-c1ccc2cn[nH]c2c1)Cc1ccc(cc1)C(F)(F)F |r|
Cn1ncc2ccc(cc12)-c1cnc(NC[C@@H](N)Cc2ccc(cc2)C(F)(F)F)s1 |r|
Cn1nc(N)c2ccc(cc12)-c1cnc(NC[C@@H](N)Cc2ccc(cc2)C(F)(F)F)s1 |r|
N[C@H](CNc1ncc(s1)-c1ccc2onc(N)c2c1)Cc1ccc(cc1)C(F)(F)F |r|
N[C@H](CNc1ncc(s1)-c1ccc2nnn(N)c2c1)Cc1ccc(cc1)C(F)(F)F |r|
N[C@H](CNc1ncc(s1)-c1ccc2NC(=O)CCc2c1)Cc1ccc(cc1)C(F)(F)F |r|
N[C@H](CNc1ncc(s1)-c1ccc2cn[nH]c(=O)c2c1)Cc1ccc(cc1)C(F)(F)F |r|
N[C@H](CNc1ncc(s1)-c1ccc(cc1)C(N)=O)Cc1ccc(cc1)C(F)(F)F |r|
N[C@H](CNc1nnc(o1)-c1ccc2cnccc2c1)Cc1ccc(cc1)C(F)(F)F |r|
N[C@H](CNc1ncc(s1)-c1ccc2nnccc2c1)Cc1ccc(cc1)C(F)(F)F |r|
Cn1nnnc1-c1cnc(-c2ccc(CN3CCC(CC3)n3c4ccccc4[nH]c3=O)cc2)c(c1)-c1ccccc1
FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(c1)-c1ccnc2cc(nn12)-c1ccncc1
FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(c1)-c1ncnc2sc(cc12)-c1ccncc1
[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@H](-[#6]-[#16])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](-[#7])=O |r|
[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](-[#7])=O |r|
[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](-[#7])=O |r|
[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6])-[#7](-[#6])-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](-[#7])=O |r|
[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](-[#7])=O |r|
[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](-[#7])=O |r|
CCn1c(nc2c(nc(O[C@H](CCN)c3ccccc3)cc12)C#CC(C)(C)O)-c1nonc1N |r|
CCn1c(nc2c(nc(O[C@@H](CCN)c3ccccc3)cc12)C#CC(C)(C)O)-c1nonc1N |r|
CCn1c(nc2c(nc(O[C@H](CN)c3ccccc3)cc12)C#CC(C)(C)O)-c1nonc1N |r|
CCn1c(nc2c(nc(O[C@@H](CN)c3ccccc3)cc12)C#CC(C)(C)O)-c1nonc1N |r|
CCn1c(nc2c(nc(OC[C@H](N)Cc3ccccc3)cc12)C#CC(C)(C)O)-c1nonc1N |r|
CCn1c(nc2c(nc(OCCCN)cc12)C#CC(C)(C)O)-c1nonc1N
CCn1c(nc2c(nc(OCCN)cc12)C#CC(C)(C)O)-c1nonc1N
CCn1c(nc2c(nc(CCCN)cc12)C#CC(C)(C)O)-c1nonc1N
CCn1c(nc2c(nc(CNC)cc12)C#CC(C)(C)O)-c1nonc1N
CCn1c(nc2c(nc(CN(C)C)cc12)C#CC(C)(C)O)-c1nonc1N
CCn1c(nc2c(nc(CN3CCCC3)cc12)C#CC(C)(C)O)-c1nonc1N
CCn1c(nc2c(nc(OCCCCN)cc12)C#CC(C)(C)O)-c1nonc1N
CCn1c(nc2c(nc(OCCNC)cc12)C#CC(C)(C)O)-c1nonc1N
CCn1c(nc2c(nc(OC[C@@H](C)N)cc12)C#CC(C)(C)O)-c1nonc1N |r|
CCn1c(nc2c(nc(OC[C@H](C)N)cc12)C#CC(C)(C)O)-c1nonc1N |r|
CCn1c(nc2c(nc(OC[C@H](N)c3ccccc3)cc12)C#CC(C)(C)O)-c1nonc1N |r|
CCn1c(nc2c(nc(OC[C@@H](N)c3ccccc3)cc12)C#CC(C)(C)O)-c1nonc1N |r|
CCn1c(nc2c(nc(OC[C@@H](N)Cc3ccccc3)cc12)C#CC(C)(C)O)-c1nonc1N |r|
CCn1c(nc2c(nc(CN)cc12)C#CC(C)(C)O)-c1nonc1N
CCn1c(nc2c(nc(CCN)cc12)C#CC(C)(C)O)-c1nonc1N
COc1cc2ncc3c(N)nc(cc3c2cc1OC)-c1cncc(OCCN)c1
COc1cc2ncc3c(N)nc(cc3c2cc1OC)-c1cncc(OC[C@H](C)N)c1 |r|
COc1cc2ncc3c(N)nc(cc3c2cc1OC)-c1cncc(OC[C@@H](C)N)c1 |r|
CC[C@H](N)COc1cncc(c1)-c1cc2c(cnc3cc(OC)c(OC)cc23)c(N)n1 |r|
CC[C@@H](N)COc1cncc(c1)-c1cc2c(cnc3cc(OC)c(OC)cc23)c(N)n1 |r|
COc1cc2ncc3c(N)nc(cc3c2cc1OC)-c1cncc(OC[C@@H](N)CC(C)C)c1 |r|
COc1cc2ncc3c(N)nc(cc3c2cc1OC)-c1cncc(OC[C@H](N)CC(C)C)c1 |r|
COc1cc2ncc3c(N)nc(cc3c2cc1OC)-c1cncc(OC[C@@H](N)Cc2ccccc2)c1 |r|
COc1cc2ncc3c(N)nc(cc3c2cc1OC)-c1cncc(OC[C@H](N)Cc2ccccc2)c1 |r|
COc1cc2ncc3c(N)nc(cc3c2cc1OC)-c1cncc(OC[C@@H](N)Cc2ccc(F)cc2)c1 |r|
COc1cc2ncc3c(N)nc(cc3c2cc1OC)-c1cncc(OC[C@H](N)Cc2ccc(F)cc2)c1 |r|
COc1cc2ncc3c(N)nc(cc3c2cc1OC)-c1cncc(OC[C@@H](N)Cc2cccc(c2)C(F)(F)F)c1 |r|
COc1cc2ncc3c(N)nc(cc3c2cc1OC)-c1cncc(OC[C@H](N)Cc2cccc(c2)C(F)(F)F)c1 |r|
COc1cc2ncc3c(N)nc(cc3c2cc1OC)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1 |r|
COc1cc2ncc3c(N)nc(cc3c2cc1OC)-c1cncc(OC[C@H](N)Cc2c[nH]c3ccccc23)c1 |r|
COc1cc2ncc3c(N)nc(cc3c2cc1OC)-c1cncc(OC[C@@H](N)Cc2ccccc2Cl)c1 |r|
COc1cc2ncc3c(N)nc(cc3c2cc1OC)-c1cncc(OC[C@@H](N)Cc2cccc(Cl)c2)c1 |r|
COc1cc2ncc3c(N)nc(cc3c2cc1OC)-c1cncc(OC[C@@H](N)Cc2ccc(Cl)c(Cl)c2)c1 |r|
COc1cc2ncc3c(N)nc(cc3c2cc1OC)-c1cncc(OC[C@@H](N)Cc2ccncc2)c1 |r|
COc1cc(Nc2c(cnc3cc(\C=C\CCN4CCN(C)CC4)c(OC)cc23)C#N)c(Cl)cc1Cl
COc1ccc(cc1Nc1ncc2CCc3c(nn(C)c3-c2n1)C(N)=O)N1CCN(C)CC1
Cc1nc(N)sc1-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1
CC(C)COC(=O)Nc1ccc(cc1)-c1cnc2c(cnn2c1N)-c1ccc(cc1)N1CCN(C)CC1
CCN[C@@H]1CCN(C1)c1ncnc2[nH]cc(C)c12 |r|
Cc1c[nH]c2ncnc(N3CC[C@H](C3)NC(=O)Nc3ccccc3)c12 |r|
Cc1c[nH]c2ncnc(N3CC[C@H](C3)NS(=O)(=O)c3ccccc3)c12 |r|
Cc1c[nH]c2ncnc(N3CC[C@H](C3)NS(C)(=O)=O)c12 |r|
Cc1c[nH]c2ncnc(N3CC[C@H](C3)NC(=O)c3ccccc3)c12 |r|
CC(=O)N[C@@H]1CCN(C1)c1ncnc2[nH]cc(C)c12 |r|
Clc1c[nH]c2ncnc(N3CCC4(C3)CCNCC4)c12
NC1CCCN(C1)c1ncnc2[nH]cc(Cl)c12
Cc1c[nH]c2ncnc(N3CC[C@@H](N)C3)c12 |r|
N[C@@H]1CCN(C1)c1ncnc2[nH]cc(Cl)c12 |r|
CCc1c[nH]c2ncnc(N3CC[C@](N)(CNC(=O)c4ccc(F)cc4F)C3)c12 |r|
N[C@]1(CNC(=O)c2ccc(F)cc2F)CCN(C1)c1ncnc2[nH]cc(Cl)c12 |r|
Cc1c[nH]c2ncnc(N3CC[C@](N)(CNC(=O)c4ccc(F)cc4F)C3)c12 |r|
N[C@]1(CNC(=O)c2ccc(F)cc2F)CCN(C1)c1ncnc2[nH]cc(C#N)c12 |r|
CCc1c[nH]c2ncnc(N3CC[C@](N)(CNC(=O)c4ccc(Cl)cc4)C3)c12 |r|
N[C@]1(CNC(=O)c2ccc(Cl)cc2)CCN(C1)c1ncnc2[nH]cc(Cl)c12 |r|
Cc1c[nH]c2ncnc(N3CC[C@](N)(CNC(=O)c4ccc(Cl)cc4)C3)c12 |r|
N[C@]1(CNC(=O)c2ccc(Cl)cc2)CCN(C1)c1ncnc2[nH]cc(C#N)c12 |r|
CCc1c[nH]c2ncnc(N3CC[C@](N)(CNC(=O)c4ccc(F)cc4)C3)c12 |r|
N[C@]1(CNC(=O)c2ccc(F)cc2)CCN(C1)c1ncnc2[nH]cc(Cl)c12 |r|
Cc1c[nH]c2ncnc(N3CC[C@](N)(CNC(=O)c4ccc(F)cc4)C3)c12 |r|
N[C@]1(CNC(=O)c2ccc(F)cc2)CCN(C1)c1ncnc2[nH]cc(C#N)c12 |r|
Cc1c[nH]c2ncnc(N3CCC(N)(CNC(=O)c4cccc(F)c4)C3)c12
CC(=O)NCC1(N)CCN(C1)c1ncnc2[nH]cc(C)c12
Cc1c[nH]c2ncnc(N3CCC(N)(CNC(=O)c4ccccc4)C3)c12
Cc1c[nH]c2ncnc(N3CCC(N)(CNC(=O)c4ccccc4F)C3)c12
Cc1c[nH]c2ncnc(N3CCC(N)(CNC=O)C3)c12
Cc1c[nH]c2ncnc(N3CCC(N)(CNC(Cl)=O)C3)c12
Cc1c[nH]c2ncnc(N3CCC(N)(CNC(=O)C(F)(F)F)C3)c12
Cc1c[nH]c2ncnc(N3CCC(N)(CNC(=O)Oc4ccccc4)C3)c12
Cc1c[nH]c2ncnc(N3CC[C@H](C3)NCc3ccccc3)c12 |r|
CNC(=O)c1cc(ccn1)Oc2ccc(cc2)NC(=O)Nc3ccc(c(c3)C(F)(F)F)Cl
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
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|
CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C
CC(C)(C)c1cc(NC(=O)Nc2ccc(cc2)-c2cn3c(n2)sc2cc(OCCN4CCOCC4)ccc32)no1
CNc1nccc(n1)-c1cccnc1Oc1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1C
CNc1nccc(n1)-c1cccnc1Oc1ccc(NC(=O)c2ccccc2Nc2ccccc2)cc1
CNc1nccc(n1)-c1cccnc1Oc1ccc(Nc2nnc(-c3ccc(F)cc3)c3ccccc23)cc1
COc1ccccc1N1CCN(CC1)c1ncnc2n[nH]c(Br)c12
CCCc1cc(cc2c(C)n[nH]c12)-c1cncc(OC[C@@H](N)Cc2c[nH]c3ccccc23)c1 |r|
CC(C)(C)n1nc(Cc2cccc(I)c2)c2c(N)ncnc12
N[C@H](Cc1ccc(F)c(F)c1)C(=O)N1CCN(CC1)c1ncnc2ccccc12 |r|
N[C@H](Cc1ccc(cc1)C(F)(F)F)C(=O)N1CCN(CC1)c1ncnc2ccccc12 |r|
N[C@H](Cc1ccc(cc1)-c1ccccc1)C(=O)N1CCN(CC1)c1ncnc2ccccc12 |r|
N[C@H](Cc1cc(F)cc(F)c1)C(=O)N1CCN(CC1)c1ncnc2ccccc12 |r|
COc1cc(C[C@@H](N)C(=O)N2CCN(CC2)c2ncnc3ccccc23)cc(OC)c1 |r|
N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc2cc(F)ccc12 |r|
Cc1cccc2ncnc(N3CCN(CC3)C(=O)[C@H](N)Cc3ccc(Cl)cc3)c12 |r|
Cc1ccc2ncnc(N3CCN(CC3)C(=O)[C@H](N)Cc3ccc(Cl)cc3)c2c1 |r|
N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc2ccc(cc12)-c1cn[nH]c1 |r|
N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc2ccc(N)cc12 |r|
CNc1ccc2ncnc(N3CCN(CC3)C(=O)[C@H](N)Cc3ccc(Cl)cc3)c2c1 |r|
CN(C)c1ccc2ncnc(N3CCN(CC3)C(=O)[C@H](N)Cc3ccc(Cl)cc3)c2c1 |r|
CC(=O)Nc1ccc2ncnc(N3CCN(CC3)C(=O)[C@H](N)Cc3ccc(Cl)cc3)c2c1 |r|
N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc2ccc(cc12)-c1ccccc1 |r|
CC(C)(C)c1ccc2ncnc(N3CCN(CC3)C(=O)[C@H](N)Cc3ccc(Cl)cc3)c2c1 |r|
N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ccnc2ccccc12 |r|
N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1cnnc2ccccc12 |r|
N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ccnc2ccnn12 |r|
N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc2cc[nH]c12 |r|
N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ccnc2[nH]ccc12 |r|
N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1cnc2ccccn12 |r|
N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ccncn1 |r|
N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ccnc2cc[nH]c12 |r|
N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc2[nH]ccc12 |r|
N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc2n[nH]cc12 |r|
Cc1c[nH]c2ncnc(N3CCN(CC3)C(=O)[C@H](N)Cc3ccc(Cl)cc3)c12 |r|
CCc1c[nH]c2ncnc(N3CCN(CC3)C(=O)[C@H](N)Cc3ccc(Cl)cc3)c12 |r|
N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc2[nH]cc(C3CC3)c12 |r|
N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc2[nH]cc(Cl)c12 |r|
NC[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc2[nH]ccc12 |r|
Cc1c[nH]c2ncnc(N3CCN(CC3)C(=O)[C@H](CN)Cc3ccc(Cl)cc3)c12 |r|
CNC[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc2[nH]ccc12 |r|
CN(C)C[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc2[nH]ccc12 |r|
Cc1c[nH]c2ncnc(N3CCN(CC3)C(=O)[C@H](N)Cc3ccc(F)cc3)c12 |r|
Cc1c[nH]c2ncnc(N3CCN(CC3)C(=O)[C@H](N)C3Cc4ccccc4C3)c12 |r|
NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(Cl)cc1 |r|
NC[C@@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc2[nH]ccc12 |r|
NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2[nH]cc(Cl)c12)c1ccc(Cl)c(Cl)c1 |r|
CC(C)c1ccc(C[C@@H](CN)C(=O)N2CCN(CC2)c2ncnc3[nH]ccc23)cc1 |r|
Cc1ccc2c(ncnc2c1)N1CCN(CC1)C(=O)[C@H](N)Cc1ccc(Cl)cc1 |r|
N[C@H](Cc1ccccc1)C(=O)N1CCN(CC1)c1ncnc2ccccc12 |r|
N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc2ccccc12 |r|
N[C@H](Cc1ccc(cc1)C#N)C(=O)N1CCN(CC1)c1ncnc2ccccc12 |r|
N[C@H](Cc1ccc(F)cc1)C(=O)N1CCN(CC1)c1ncnc2ccccc12 |r|
COc1ccc(C[C@@H](N)C(=O)N2CCN(CC2)c2ncnc3ccccc23)cc1 |r|
Cc1ccc(C[C@@H](N)C(=O)N2CCN(CC2)c2ncnc3ccccc23)cc1 |r|
N[C@H](Cc1ccc(Br)cc1)C(=O)N1CCN(CC1)c1ncnc2ccccc12 |r|
N[C@H](Cc1ccccc1Cl)C(=O)N1CCN(CC1)c1ncnc2ccccc12 |r|
N[C@H](Cc1cccc(Cl)c1)C(=O)N1CCN(CC1)c1ncnc2ccccc12 |r|
N[C@H](Cc1ccc(Cl)cc1Cl)C(=O)N1CCN(CC1)c1ncnc2ccccc12 |r|
N[C@H](Cc1ccc(Cl)c(Cl)c1)C(=O)N1CCN(CC1)c1ncnc2ccccc12 |r|
Cc1ccc(cn1)-c1nc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCCO)c1=O |r,wU:18.19,wD:21.26,(6.04,1.56,;4.72,.78,;4.73,-.76,;3.4,-1.53,;2.06,-.77,;2.05,.76,;3.37,1.55,;.74,-1.54,;-.6,-.78,;-1.93,-1.56,;-3.26,-.79,;-3.27,.75,;-4.59,-1.56,;-4.59,-3.11,;-5.93,-3.88,;-3.26,-3.88,;-1.93,-3.1,;-.59,-3.87,;-.59,-5.41,;.75,-6.17,;.75,-7.72,;-.59,-8.49,;-1.92,-7.71,;-1.92,-6.18,;-.59,-10.03,;-1.93,-10.8,;-1.93,-12.34,;-3.26,-13.1,;.74,-3.09,;2.08,-3.86,)|
Cc1nc(N)nc2n(C3CCOCC3)c(=O)c(nc12)-c1cc[nH]n1
COc1ccc(cn1)-c1nc2c(C)nc(N)nc2n([C@H]2CC[C@H](O)CC2)c1=O |r,wU:19.20,wD:22.24,(6.1,-15.1,;4.76,-14.34,;3.43,-15.12,;3.44,-16.66,;2.11,-17.44,;.77,-16.67,;.76,-15.14,;2.09,-14.36,;-.55,-17.45,;-1.88,-16.69,;-3.21,-17.46,;-4.55,-16.7,;-4.55,-15.16,;-5.87,-17.47,;-5.88,-19.01,;-7.21,-19.78,;-4.54,-19.78,;-3.21,-19,;-1.87,-19.77,;-1.87,-21.31,;-.53,-22.08,;-.54,-23.62,;-1.87,-24.39,;-1.87,-25.93,;-3.2,-23.62,;-3.2,-22.08,;-.54,-19,;.8,-19.76,)|
Cc1ccc(cn1)-c1nc2c(C)nc(N)nc2n(C2CCOCC2)c1=O
Cc1ccc(cn1)-c1nc2c(C)nc(N)nc2n([C@H]2CC[C@H](O)CC2)c1=O |r,wU:21.23,wD:18.19,(6.09,-29.48,;4.76,-30.26,;4.77,-31.8,;3.44,-32.58,;2.1,-31.81,;2.09,-30.28,;3.42,-29.5,;.78,-32.59,;-.55,-31.83,;-1.88,-32.6,;-3.22,-31.84,;-3.22,-30.3,;-4.54,-32.61,;-4.55,-34.15,;-5.88,-34.92,;-3.21,-34.92,;-1.88,-34.14,;-.54,-34.91,;-.54,-36.45,;-1.87,-37.22,;-1.87,-38.76,;-.54,-39.53,;-.54,-41.07,;.79,-38.76,;.8,-37.22,;.79,-34.14,;2.13,-34.9,)|
O=C(N[C@H](CN1CCCC1)c1ccccc1)c1cc2n[nH]c(NC(=O)c3ccc(cc3)N3CCOCC3)c2s1 |r|
C[C@@H](N1C[C@H](C)O[C@H](C)C1)c1cc(Nc2nc(C)cn3c(cnc23)-c2cn[nH]c2)sn1 |r|
O=S(=O)(Nc1nc(NCCc2ccccc2)nc2CCN(Cc3ccccc3)Cc12)c1ccc2ccccc2c1
Cc1c(Cl)cccc1S(=O)(=O)Nc1nc(NCCc2ccccc2)nc2CCN(Cc3ccccc3)Cc12
CC(C)c1n[nH]c(Cl)c1-c1ccnc(Nc2ccc(cn2)N2CCC(CC2)N(C)C)n1
CC(C)c1[nH]nc(c1-c1ccnc(Nc2ccc(cn2)N2CCC(CC2)N(C)C)n1)C(F)(F)F
N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc2CSCc12 |r|
N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc2CS(=O)(=O)Cc12 |r|
CC1SCc2ncnc(N3CCN(CC3)C(=O)[C@H](N)Cc3ccc(Cl)cc3)c12 |r|
CCC1SCc2ncnc(N3CCN(CC3)C(=O)[C@H](N)Cc3ccc(Cl)cc3)c12 |r|
C[C@@H]1SCc2ncnc(N3CCN(CC3)C(=O)[C@H](N)Cc3ccc(Cl)cc3)c12 |r|
C[C@H]1SCc2ncnc(N3CCN(CC3)C(=O)[C@H](N)Cc3ccc(Cl)cc3)c12 |r|
C[C@@H]1SCc2ncnc(N3CCN(CC3)C(=O)[C@H](N)Cc3ccc(Cl)c(F)c3)c12 |r|
C[C@@H]1SCc2ncnc(N3CCN(CC3)C(=O)[C@H](N)Cc3ccc(F)cc3)c12 |r|
C[C@@H]1SCc2ncnc(N3CCN(CC3)C(=O)[C@H](N)Cc3ccc(F)c(F)c3)c12 |r|
C[C@@H]1SCc2ncnc(N3CCN(CC3)C(=O)[C@H](N)Cc3c[nH]c4ccccc34)c12 |r|
C[C@@H]1OCc2ncnc(N3CCN(CC3)C(=O)[C@H](N)Cc3ccc(Cl)cc3)c12 |r|
C[C@@H]1SCc2ncnc(N3CCN(CC3)C(=O)C(Cc3ccc(Cl)cc3)C3(N)CC3)c12 |r|
CC(C)NCC(Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc2CS[C@@H](C)c12 |r|
C[C@@H]1SCc2ncnc(N3CCN(CC3)C(=O)C(CN3CCCC3)Cc3ccc(Cl)cc3)c12 |r|
CC(C)NCC(Cc1ccc(C)cc1)C(=O)N1CCN(CC1)c1ncnc2CS[C@@H](C)c12 |r|
CC(C)NCC(Cc1ccc(Cl)c(F)c1)C(=O)N1CCN(CC1)c1ncnc2CS[C@@H](C)c12 |r|
CC(C)NCC(Cc1ccc(F)c(F)c1)C(=O)N1CCN(CC1)c1ncnc2CS[C@@H](C)c12 |r|
CC(C)NC[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc2CS[C@@H](C)c12 |r|
CC(C)NC[C@@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc2CS[C@@H](C)c12 |r|
C[C@@H]1SCc2ncnc(N3CCN(CC3)C(=O)C(Cc3ccc(Cl)c(F)c3)CC3(N)CC3)c12 |r|
C[C@@H]1SCc2ncnc(N3CCN(CC3)C(=O)C(Cc3ccc(Cl)cc3)CC(C)(C)N)c12 |r|
C[C@@H]1SCc2ncnc(N3CCN(CC3)C(=O)C(Cc3ccc(Cl)c(F)c3)CC(C)(C)N)c12 |r|
CC(C)NCC(Cc1ccc(C)cc1)C(=O)N1CCN(CC1)c1ncnc2CO[C@@H](C)c12 |r|
CC(C)NCC(Cc1ccc(Cl)c(F)c1)C(=O)N1CCN(CC1)c1ncnc2CO[C@@H](C)c12 |r|
CC(C)NC[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc2CO[C@@H](C)c12 |r|
C[C@@H]1OCc2ncnc(N3CCN(CC3)C(=O)C(Cc3ccc(Cl)c(F)c3)CC(C)(C)N)c12 |r|
CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nnc(C)s1
CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nnc(CC)s1
CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nnc(s1)C(C)(C)C
CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nnc(CC(O)=O)s1
CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nnc(CC(=O)OCC)s1
CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nnc(s1)C(=O)OCC
CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nnc(CO)s1
CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nnc(s1)S(N)(=O)=O
CCCCc1ccc(cc1)S(=O)(=O)Nc1nncs1
CCCCCCc1ccc(cc1)S(=O)(=O)Nc1nncs1
CCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nncs1
CCCCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nncs1
CCCCCCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nncs1
CCCCCCCCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nncs1
CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nnc(C)s1
CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nnc(CC)s1
CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nnc(s1)C(C)(C)C
CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nnc(CC(O)=O)s1
CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nnc(CC(=O)OCC)s1
CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nnc(s1)C(=O)OCC
CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nnc(CO)s1
CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1nnc(s1)S(N)(=O)=O
O=S(=O)(Nc1nncs1)c1ccc(cc1)-c1ccccc1
CCc1nnc(NS(=O)(=O)c2ccc(cc2)-c2ccccc2)s1
OCc1nnc(NS(=O)(=O)c2ccc(cc2)-c2ccccc2)s1
CCCCCCCCCCCCc1ccc(cc1)S(=O)(=O)Nc1ccccc1
CCCCCCCCCCCCc1ccccc1S(=O)(=O)Nc1nncs1
CCCCCCCCCCCCc1cccc(c1)S(=O)(=O)Nc1nncs1
CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(O)(=O)O[C@@H]1[C@H](O)[C@H](OP(O)(O)=O)[C@@H](OP(O)(O)=O)[C@H](OP(O)(O)=O)[C@H]1O)OC(=O)CCCCCCCCCCCCCCC |r|
CCCCCCCCCCCCCCCCCCOC[C@H](COP(O)(=O)O[C@@H]1[C@H](O)C[C@@H](O)[C@H](O)[C@H]1O)OC |r|
Nc1n[nH]c2cc(ccc12)-c1ccnc(N)n1
c1cc(c(cc1[N+](=O)[O-])Cl)NC(=O)c2cc(ccc2O)Cl
CCOCCN(C[C@@H](O)CN1CCCC2(CCc3c(O2)ccc2[nH]ncc32)C1)S(=O)(=O)c1c(C)cccc1C |r|
CCOCCN(C[C@@H](O)CN1CCCC2(CCc3cc4C(=O)NCc4cc3O2)C1)S(=O)(=O)c1c(C)cccc1C |r|
CCOCCN(C[C@@H](O)CN1CCCC2(CCc3cc(ccc3O2)C(N)=O)C1)S(=O)(=O)c1c(C)cccc1C |r|
CCOCCN(C[C@@H](O)CN1CCCC2(CCc3cc(O)ccc3O2)C1)S(=O)(=O)c1c(C)cccc1C |r|
CCOCCN(C[C@@H](O)CN1CCCC2(CCc3cc(O)ccc3O2)C1)S(=O)(=O)c1c(C)noc1C |r|
CCOCCN(C[C@@H](O)CN1CCCC2(CCc3cc(ccc3O2)C#N)C1)S(=O)(=O)c1c(C)cccc1C |r|
CCOCCN(C[C@@H](O)CN1CCCC2(CCc3cc(F)ccc3O2)C1)S(=O)(=O)c1c(C)cccc1C |r|
CC(C)OCCN(C[C@@H](O)CN1CCCC2(C1)CC(=O)c1cc(O)ccc1O2)S(=O)(=O)c1c(C)noc1C |r|
CCOCCN(C[C@@H](O)CN1CCCC2(C1)CC(=O)c1cc(O)ccc1O2)S(=O)(=O)c1c(C)cccc1C |r|
CCOCCN(C[C@@H](O)CN1CCCC2(C1)CC(=O)c1cc(O)ccc1O2)S(=O)(=O)c1ccccc1C |r|
CCOCCN(C[C@@H](O)CN1CCCC2(C1)CC(=O)c1cc(O)ccc1O2)S(=O)(=O)c1c(C)noc1C |r|
CCOCCN(C[C@@H](O)CN1CCCC2(C1)CC(=O)c1cc(O)ccc1O2)S(=O)(=O)c1ccccc1Cl |r|
CCCCCN(C[C@@H](O)CN1CCCC2(C1)CC(=O)c1cc(O)ccc1O2)S(=O)(=O)c1c(C)noc1C |r|
CCOCCN(C[C@@H](O)CN1CCCC2(C1)CC(=O)c1cc(O)ccc1O2)S(=O)(=O)c1ccccc1C(F)(F)F |r|
COCCN(C[C@@H](O)CN1CCCC2(C1)CC(=O)c1cc(O)ccc1O2)S(=O)(=O)c1c(C)noc1C |r|
Cc1noc(C)c1S(=O)(=O)N(CC(O)CN1CCCC2(C1)CC(=O)c1cc(O)ccc1O2)Cc1ccccc1
Cc1noc(C)c1S(=O)(=O)N(C[C@@H](O)CN1CCCC2(C1)CC(=O)c1cc(O)ccc1O2)C1CCCCC1 |r|
CCOCCN(C[C@@H](O)CN1CCCC2(C1)CC(=O)c1cc(O)ccc1O2)S(=O)(=O)c1ccccc1C#N |r|
CCOCCN(C[C@@H](O)CN1CCCC2(C1)CC(=O)c1cc(O)ccc1O2)S(=O)(=O)c1ccccc1F |r|
COCCN(C[C@H](O)CN1CCCC2(C1)CC(=O)c1cc(O)ccc1O2)S(=O)(=O)c1c(C)noc1C |r|
CCOCCN(C[C@@H](O)CN1CCCC2(C1)CC(=O)c1cc(O)ccc1O2)S(=O)(=O)c1cccc(Cl)c1 |r|
CCOCCN(C[C@@H](O)CN1CCCC2(C1)CC(=O)c1cc(O)ccc1O2)S(=O)(=O)c1ccccc1OC |r|
CCOCCN(C[C@@H](O)CN1CCCC2(C1)CC(=O)c1cc(O)ccc1O2)S(=O)(=O)c1ccc(Cl)cc1 |r|
Cc1cccc(C)c1S(=O)(=O)N1CCC[C@H]1[C@@H](O)CN1CCC[C@@]2(CCN(C2)c2ncnc(N)c2C2CC2)C1 |r|
Cc1cccc(C)c1S(=O)(=O)N1CCC[C@H]1[C@H](O)CN1CCC[C@@]2(CCN(C2)c2ncnc(N)c2C2CC2)C1 |r|
Cc1cccc(C)c1S(=O)(=O)N1CCC[C@@H]1[C@@H](O)CN1CCC[C@@]2(CCN(C2)c2ncnc(N)c2C2CC2)C1 |r|
Cc1cccc(C)c1S(=O)(=O)NC[C@@H](O)CN1CCC[C@@]2(CCN(C2)c2ncnc(N)c2C2CC2)C1 |r|
Cc1ccccc1S(=O)(=O)NC[C@@H](O)CN1CCC[C@@]2(CCN(C2)c2ncnc(N)c2C2CC2)C1 |r|
Nc1ncnc(N2CC[C@]3(C2)CCCN(C[C@H](O)CNS(=O)(=O)c2ccccc2F)C3)c1C1CC1 |r|
Nc1ncnc(N2CC[C@]3(C2)CCCN(C[C@H](O)CNS(=O)(=O)c2ccccc2Cl)C3)c1C1CC1 |r|
Nc1ncnc(N2CC[C@]3(C2)CCCN(C[C@H](O)CNS(=O)(=O)c2ccccc2Br)C3)c1C1CC1 |r|
Cc1cc(F)ccc1S(=O)(=O)NC[C@@H](O)CN1CCC[C@@]2(CCN(C2)c2ncnc(N)c2C2CC2)C1 |r|
Cc1ccc(c(C)c1)S(=O)(=O)NC[C@@H](O)CN1CCC[C@@]2(CCN(C2)c2ncnc(N)c2C2CC2)C1 |r|
Cc1ccncc1S(=O)(=O)NC[C@@H](O)CN1CCC[C@@]2(CCN(C2)c2ncnc(N)c2C2CC2)C1 |r|
Cc1noc(C)c1S(=O)(=O)NC[C@@H](O)CN1CCC[C@@]2(CCN(C2)c2ncnc(N)c2C2CC2)C1 |r|
CCOCCN(C[C@@H](O)CN1CCCC2(CCN(CC2)c2ncnc3[nH]cc(C)c23)C1)S(=O)(=O)c1c(C)cccc1C |r|
CCOCCN(C[C@@H](O)CN1CCCC2(CCN(C2)c2ncnc3[nH]cc(C)c23)C1)S(=O)(=O)c1c(C)cccc1C |r|
CCOCCN(C[C@@H](O)CN1CCC2(CCN(C2)c2ncnc3n[nH]c(C)c23)C1)S(=O)(=O)c1c(C)cccc1C |r|
CCOCCN(C[C@@H](O)CN1CCCC2(CCN(C2)c2ncnc3n[nH]c(C)c23)C1)S(=O)(=O)c1c(C)cccc1C |r|
CCOCCN(C[C@@H](O)CN1CCCC2(CCN(C2)c2ncnc3ccccc23)C1)S(=O)(=O)c1c(C)cccc1C |r|
CCOCCN(C[C@@H](O)CN1CCCC2(CCN(C2)c2ncncc2C2CC2)C1)S(=O)(=O)c1c(C)cccc1C |r|
CCOCCN(C[C@@H](O)CN1CCCC2(CCN(C2)c2ncnc(N)c2C2CC2)C1)S(=O)(=O)c1c(C)cccc1C |r|
CNc1nc(cc(n1)-c1ccc2c(N)n[nH]c2c1)N1C[C@H](CC[C@H]1C)C(=O)NC1CCCCC1 |r|
CNc1cncc(n1)-c1c[nH]c(=O)c(NC(=O)c2ccc(cc2)N2CCC[C@H]2CN2CCCC2)c1 |r|
CCN(c1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1)S(=O)(=O)c1ccc(OC)cc1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(NS(=O)(=O)c2ccccc2F)n1
CN(c1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1)S(=O)(=O)c1ccccc1F
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(NS(=O)(=O)c2cccc(F)c2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(NS(=O)(=O)c2ccc(F)cc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(NS(=O)(=O)c2ccc(C)cc2)n1
CN(c1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1)S(=O)(=O)c1ccc(C)cc1
COc1ccc(cc1)S(=O)(=O)Nc1cc(ccn1)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)Nc1cncc(c1)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)Nc1cncc(n1)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)Nc1cccc(c1)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1C#N)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1C)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nc(NC(C)=O)sc2c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2C(F)(F)F)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2cccc(c2)C(F)(F)F)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(cc2)C(F)(F)F)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2Cl)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2cccc(Cl)c2)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(Cl)cc2)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2cccc(c2)C(C)(C)C)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(cc2)C(C)(C)C)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccccc2F)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2cccc(F)c2)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(NCc2ccccc2)n1
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(NC(C)(C)c2ccccc2)n1
COc1ccc(cc1)S(=O)(=O)Nc1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1
COc1ccc(cc1)S(=O)(=O)N(C)c1nccc(n1)-c1ccc2nc(NC(C)=O)sc2c1
CN1CCN(CC1)c1ccc(OC(F)(F)F)c(Nc2ncc3CCc4c(nn(CCO)c4-c3n2)C(N)=O)c1
CC1(C)c2[nH]c3cc(ccc3c2C(=O)c2ccc(cc12)C1CCN(CC1)C1COC1)C#N
[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-1-[#6]-[#6]-[#6]-[#6]-[#6]-1)-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](-[#7])=O |r|
[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](-[#7])=O |r|
[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](-[#7])=O |r|
[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7](-[#6]-[#6]-[#7])-[#6]-[#6](-[#7])=O |r|
[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7](-[#6]-[#6]-[#7])-[#6]-[#6](-[#7])=O |r|
[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7](-[#6]-[#6]-[#7])-[#6]-[#6](-[#7])=O |r|
[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6]-[#7])-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7](-[#6]-[#6]-[#6]-[#7])-[#6]-[#6](-[#7])=O |r|
[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7](-[#6]-[#6]-[#6]-[#7])-[#6]-[#6](-[#7])=O |r|
[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7](-[#6]-[#6]-[#6]-[#7])-[#6]-[#6](-[#7])=O |r|
[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7](-[#6]-[#6]-[#6]-[#7])-[#6]-[#6](-[#7])=O |r|
[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6]-[#7])-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6]-[#6](-[#7])=O |r|
[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6]-[#6](-[#7])=O |r|
[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6]-[#6](-[#7])=O |r|
[#6]-[#6]-[#6]-[#6@@H]-1-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6]-[#7]-[#6](=O)-[#7]-[#6]-[#6]-[#6]-[#7](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c2ccc(-[#8])cc2)-[#7]-[#6]-1=O)-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7] |r|
[#6]-[#6]-[#6]-[#6@@H]-1-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6]-[#6]-[#7]-[#6](=O)-[#7]-[#6]-[#6]-[#6]-[#7](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c2ccc(-[#8])cc2)-[#7]-[#6]-1=O)-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7] |r|
[#6]-[#6]-[#6]-[#6@@H]-1-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#7]-[#6](=O)-[#7]-[#6]-[#6]-[#6]-[#7](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c2ccc(-[#8])cc2)-[#7]-[#6]-1=O)-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7] |r|
[#6]-[#6]-[#6]-[#6@@H]-1-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6]-[#7]-[#6](=O)-[#7]-[#6]-[#6]-[#6]-[#6]-[#7](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c2ccc(-[#8])cc2)-[#7]-[#6]-1=O)-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7] |r|
[#6]-[#6]-[#6]-[#6@@H]-1-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6]-[#6]-[#6]-[#7]-[#6](=O)-[#7]-[#6]-[#6]-[#6]-[#6]-[#7](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c2ccc(-[#8])cc2)-[#7]-[#6]-1=O)-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7] |r|
[#6]-[#6]-[#6]-[#6@@H]-1-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#7]-[#6](=O)-[#7]-[#6]-[#6]-[#6]-[#6]-[#7](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c2ccc(-[#8])cc2)-[#7]-[#6]-1=O)-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7] |r|
[#6]-[#6]-[#6]-[#6@@H]-1-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6]-[#7]-[#6](=O)-[#7]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#7](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c2ccc(-[#8])cc2)-[#7]-[#6]-1=O)-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7] |r|
[#6]-[#6]-[#6]-[#6@@H]-1-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6]-[#6]-[#7]-[#6](=O)-[#7]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#7](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c2ccc(-[#8])cc2)-[#7]-[#6]-1=O)-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7] |r|
[#6]-[#6]-[#6]-[#6@@H]-1-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6]-[#6]-[#7]-[#6](=O)-[#7]-[#6]-[#6]-[#7](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c2ccc(-[#8])cc2)-[#7]-[#6]-1=O |r|
[#6]-[#6]-[#6]-[#6@@H]-1-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6]-[#6]-[#6]-[#7]-[#6](=O)-[#7]-[#6]-[#6]-[#7](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c2ccc(-[#8])cc2)-[#7]-[#6]-1=O |r|
[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6]-[#6](-[#7])=O |r|
CSc1cn2c(cnc2c(Nc2cc(C)ns2)n1)-c1cn[nH]c1
Cc1ccc(cc1Nc2c3c(c(cn3ncn2)C(=O)c4ccccc4)C)C(=O)NC5CC5
Cc1cc(O)cc2oc3cc(O)cc(O)c3c(=O)c12
Cc1c(O)c(O)cc2oc3cc(O)cc(O)c3c(=O)c12
c1cc2cc[nH]c2nc1
c1ccc2c(c1)cn[nH]2
Nc1nc2ccc(cc2s1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncsc2c1
CC(=O)Nc1cn2nc(ccc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Nc1cn2nc(ccc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccn2n1
CC(=O)Nc1cn2cc(ccc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Nc1cn2cc(ccc2n1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccn2c1
CC(=O)Nc1nc2ccc(cc2[nH]1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nc[nH]c2c1
CC(=O)Nc1nc2ccc(cc2o1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Nc1nc2ccc(cc2o1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2ncoc2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nncn2c1
Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2sncc2c1
Nc1nc2ccc(cc2[nH]1)-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
CCc1cc2C(=O)c3c([nH]c4cc(ccc34)C#N)C(C)(C)c2cc1N1CCN(CC1)C1COC1
Clc1ccc(cc1Cl)C(NC(=O)c1ccc2cnccc2c1)C1CCCNC1
Clc1ccc(cc1Cl)C(NC(=O)c1ccc2cnccc2c1)C1CCNC1
Clc1ccc(cc1Cl)[C@H](NC(=O)c1ccc2cnccc2c1)C1CNC1 |r|
Clc1ccc(cc1Cl)[C@@H](NC(=O)c1ccc2cnccc2c1)C1CNC1 |r|
Clc1ccc(cc1Cl)C(NC(=O)c1ccc2cnccc2c1)C1CCCCC1
Clc1ccc(cc1Cl)C(NC(=O)c1ccc2cnccc2c1)c1cncnc1
Clc1ccc(cc1Cl)C(NC(=O)c1ccc2cnccc2c1)c1ccncc1
CC(C)CN1CCC(CC1)[C@@H](NC(=O)c1ccc2cnccc2c1)c1ccc(Cl)c(Cl)c1 |r|
Clc1ccc(cc1Cl)[C@H](NC(=O)c1ccc2cnccc2c1)C1CCN(Cc2ccccc2)CC1 |r|
FC(F)(F)c1ccc(CN2CCC(CC2)[C@@H](NC(=O)c2ccc3cnccc3c2)c2ccc(Cl)c(Cl)c2)cc1 |r|
CN1CC(C1)[C@@H](NC(=O)c1ccc2cnccc2c1)c1ccc(Cl)c(Cl)c1 |r|
N[C@H](CNc1nnc(s1)-c1ccc2NC(=O)Cc2c1)Cc1ccc(cc1)C(F)(F)F |r|
Fc1cc2cc(ccc2cn1)C(=O)NC(C1CCNCC1)c1ccc(Cl)c(Cl)c1
N[C@H](CNC(=O)c1ccc2cnccc2c1)Cc1ccc(cc1)C(F)(F)F |r|
O=C(NC(C1CCNCC1)c1ccccc1)c1ccc2cnccc2c1
O=C(NC(C1CCNCC1)c1ccc2ccccc2c1)c1ccc2cnccc2c1
O=C(NC(C1CCNCC1)c1nccs1)c1ccc2cnccc2c1
COc1ccc(cc1F)C(NC(=O)c1ccc2cnccc2c1)C1CCNCC1
Fc1ccc(cc1F)C(NC(=O)c1ccc2cnccc2c1)C1CCNCC1
Clc1ccc(cc1-c1ccccc1)C(NC(=O)c1ccc2cnccc2c1)C1CCNCC1
Clc1ccc(cc1C#N)C(NC(=O)c1ccc2cnccc2c1)C1CCNCC1
Clc1cccc(c1)C(NC(=O)c1ccc2cnccc2c1)C1CCNCC1
Clc1ccc(cc1)C(NC(=O)c1ccc2cnccc2c1)C1CCNCC1
Fc1cc(ccc1Cl)C(NC(=O)c1ccc2cnccc2c1)C1CCNCC1
Clc1cccc(C(NC(=O)c2ccc3cnccc3c2)C2CCNCC2)c1Cl
Clc1ccc(cc1Cl)C(NC(=O)c1ccc2cnccc2c1)C1CCNCC1
Clc1cc(cnc1Cl)C(NC(=O)c1ccc2cnccc2c1)C1CCNCC1
Clc1ccc(cc1Cl)C(NC(=O)c1ccc2NC(=O)Cc2c1)C1CCNCC1
Clc1ccc(cc1Cl)C(NC(=O)c1ccc2[nH]c(=O)oc2c1)C1CCNCC1
Clc1ccc(cc1Cl)C(NC(=O)c1ccc2[nH]ncc2c1)C1CCNCC1
Clc1ccc(cc1Cl)C(NC(=O)c1ccc2cnncc2c1)C1CCNCC1
COc1cc2cnccc2cc1C(=O)NC(C1CCNCC1)c1ccc(Cl)c(Cl)c1
COc1ccc(cc1)-c1cc2cnccc2cc1C(=O)NC(C1CCNCC1)c1ccc(Cl)c(Cl)c1
Clc1cc2cc(ccc2cn1)C(=O)NC(C1CCNCC1)c1ccc(Cl)c(Cl)c1
CCN1CCN(CC1)c2ccc(cc2)Nc3cc(ncn3)N(C)C(=O)Nc4c(c(cc(c4Cl)OC)OC)Cl
O=C(N1CCNCC1)c1ccc(\C=C\c2n[nH]c3ccccc23)cc1
Cc1ccc(cc1Nc2nc(cs2)c3cccnc3)NC(=O)c4ccc(cc4)CN5CCN(CC5)C
C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl |r|
CNC(=O)c1c(F)cccc1Nc1nc(Nc2cc3N(CCc3cc2OC)C(=O)CN(C)C)nc2[nH]ccc12
Cn1cc(C2=C(C(=O)NC2=O)c2cn(C3CCN(Cc4ccccn4)CC3)c3ccccc23)c2ccccc12 |t:4|
CC1(C(=O)Nc2c(ccc(n2)Nc3c(cnc(n3)Nc4cc(c(c(c4)OC)OC)OC)F)O1)C
CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
CC[C@H]1N(C2CCCC2)c2nc(Nc3ccc(cc3OC)C(=O)NC3CCN(C)CC3)ncc2N(C)C1=O |r|
Nc1nc(N)c2nc(-c3cccc(O)c3)c(nc2n1)-c1cccc(O)c1
CN1c2c(cnc(n2)Nc3cccc(c3)SC)C=C(C1=O)c4c(cccc4Cl)Cl
c1c[nH]c2c1c(ncn2)c3cnn(c3)[C@H](CC#N)C4CCCC4
COCCOc1cc2c(cc1OCCOC)ncnc2Nc3cccc(c3)C#C
CCN(CCCOc1ccc2c(c1)ncnc2Nc3cc(n[nH]3)CC(=O)Nc4cccc(c4)F)CCO
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)Cc2c(Cl)cccc2Cl)c(C)c1C(=O)N1CCC[C@@H]1CN1CCCC1 |r|
Oc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
Cc1cccc(c1NC(=O)c2cnc(s2)Nc3cc(nc(n3)C)N4CCN(CC4)CCO)Cl
C[C@@H](O)COc1cn2ncnc(Oc3ccc4[nH]c(C)cc4c3F)c2c1C
COc1c(Cl)cc2c3ccncc3[nH]c2c1NC(=O)c1cccnc1C
Cn1cnc2c1cc(c(c2F)Nc3ccc(cc3Cl)Br)C(=O)NOCCO
c1cc(c(c(c1)Cl)C2=C3C=CC(=NN3C=NC2=O)Sc4ccc(cc4F)F)Cl
CN(C)C[C@@H]1CCn2cc(C3=C(C(=O)NC3=O)c3cn(CCO1)c1ccccc31)c1ccccc21 |r,t:10|
CC(C)(C)c1cnc(o1)CSc2cnc(s2)NC(=O)C3CCNCC3
Cn1c(Nc2ccc(cc2)C(F)(F)F)nc2cc(Oc3ccnc(c3)-c3ncc([nH]3)C(F)(F)F)ccc12
Cc1cnc2c(NCCN)nc3ccc(C)cc3n12
C[C@@H](Oc1cc(sc1C(N)=O)-n1cnc2ccc(CN3CCN(C)CC3)cc12)c1ccccc1C(F)(F)F |r|
CC(C)S(=O)(=O)c1ccccc1Nc2c(cnc(n2)Nc3ccc(cc3OC)N4CCC(CC4)N5CCN(CC5)C)Cl
CN(C)C/C=C/C(=O)Nc1cc2c(cc1O[C@H]3CCOC3)ncnc2Nc4ccc(c(c4)Cl)F
CS(=O)(=O)CCNCc1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
CC(C)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
Clc1cccc(Cl)c1C(=O)Nc1cn[nH]c1C(=O)NC1CCNCC1
COc1cc(Oc2ccnc3cc(OC)c(OC)cc23)ccc1NC(=O)NC(C)c1nccs1
CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(Cl)cc23)c1F
CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)NC4=CCC(F)C=C4)cc3F)ccnc2cc1OCCCN1CCOCC1 |c:26,t:21|
COc1cc2c(cc1OCCCN3CCOCC3)c(ncn2)Nc4ccc(c(c4)Cl)F
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)cc(c1)C(F)(F)F
OC(=O)c1ccc(Nc2ncc3CN=C(c4cc(Cl)ccc4-c3n2)c2c(F)cccc2F)cc1 |c:13|
Cn1cc(cn1)-c1ccc2nnc(Sc3ccc4ncccc4c3)n2n1
Cc1cnc(nc1Nc2cccc(c2)S(=O)(=O)NC(C)(C)C)Nc3ccc(cc3)OCCN4CCCC4
OCCn1cc(c(n1)-c1ccncc1)-c1ccc2C(CCc2c1)N=O
CC1(CNc2c1ccc(c2)NC(=O)c3cccnc3NCc4ccncc4)C
CNC(=O)c1ccccc1Sc2ccc3c(c2)[nH]nc3/C=C/c4ccccn4
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
CN1CC[C@@H]([C@H](O)C1)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1Cl |r|
C=CC(=O)Nc1cc2c(cc1OCCCN3CCOCC3)ncnc2Nc4ccc(c(c4)Cl)F
COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ncnc2cc1OCCCN1CCCC1
CCN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4cc(NC)ncn4)cc3)cc2C(F)(F)F)CC1
CN1CCN(CC1)c1cc(Nc2cc(C)n[nH]2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1
COc1ccc(cc1)COc2ccc(cc2OC)Cc3cnc(nc3N)N
CN1CCC(CC1)COc2cc3c(cc2OC)c(ncn3)Nc4ccc(cc4F)Br
COc1ccc(c(c1C(=O)c2cnc(nc2N)NC3CCN(CC3)S(=O)(=O)C)F)F
CN(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(C)c(c2)S(N)(=O)=O)n1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(OCCN2CCOCC2)c2ccccc12)C(C)(C)C
Clc1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1
CN(C)CC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:31|
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1
CN1CCN(CC1)CCCOc2cc3c(cc2OC)c(c(cn3)C#N)Nc4cc(c(cc4Cl)Cl)OC
C[C@@H]1CCN(C[C@@H]1N(C)c1ncnc2[nH]ccc12)C(=O)CC#N |r|
CS(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
Fc1ccc(C(=O)NOCC2CC2)c(Nc2ccc(I)cc2Cl)c1F
[O-][n+]1ccc2c(ccnc2c1-c1c(Cl)cccc1Cl)-c1ccc(F)cc1Cl |(12.75,-22.82,;14.08,-22.05,;14.08,-20.51,;15.41,-19.74,;16.75,-20.5,;18.08,-19.73,;19.42,-20.51,;19.42,-22.05,;18.08,-22.82,;16.74,-22.05,;15.42,-22.83,;15.42,-24.36,;14.08,-25.13,;12.75,-24.36,;14.09,-26.67,;15.42,-27.44,;16.76,-26.66,;16.75,-25.12,;18.08,-24.34,;18.08,-18.2,;19.42,-17.43,;19.42,-15.89,;18.08,-15.12,;18.08,-13.58,;16.75,-15.89,;16.75,-17.43,;15.42,-18.2,)|
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(-[#6](=O)\[#6]=[#6]\c2cccc(-[#8])c2)c(-[#8])cc1-[#8]
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])cc(-[#8])c(-[#6](=O)\[#6]=[#6]\c2ccc(-[#8])cc2)c1-[#8]
[#6]\[#6](-[#6])=[#6]/[#6]-c1c(-[#8])cc2oc(cc(=O)c2c1-[#8])-c1ccc(-[#8])cc1-[#8]
[#6]\[#6](-[#6])=[#6]/[#6]-c1c(-[#8])cc2oc(cc(=O)c2c1-[#8])-c1ccc(-[#8])c(-[#8])c1
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])cc(-[#8])c2c1oc(cc2=O)-c1ccc(-[#8])c(-[#8])c1
CC(=O)Nc1cccc(c1)-n1nnc(SCC(=O)NCc2cccs2)n1
CC(C)C\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@H](CCc3cc(O)ccc3C)[C@@H](O)CC[C@]12C |r|
CC(C)C\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@H](CCc3cc(O)ccc3C)C(=O)CC[C@]12C |r|
CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@H]2[C@H](CCc3cc(O)ccc3C)C(=O)CC[C@]12C |r|
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@H](CCc3cc(O)ccc3C)C(=O)CC[C@]12C |r|
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@H](CCc3cc(O)ccc3C)[C@H](O)CC[C@]12C |r|
CC(C)CCC[C@@H](C)[C@H]1[C@@H](O)C[C@H]2[C@H](CCc3cc(O)ccc3C)C(=O)CC[C@]12C |r|
CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@H]2[C@H](CCc3cc(O)ccc3C)[C@H](O)CC[C@]12C |r|
CC(C)CCC[C@@H](C)[C@H]1[C@@H](O)C[C@H]2[C@H](CCc3cc(O)ccc3C)[C@H](O)CC[C@]12C |r|
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6@H]-2-[#6@@H](-[#6]-[#8]-[#6](=O)-[#7]-1-2)-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1 |r|
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6@H]-2-[#6@@H](-[#6]-[#8]-[#6](=O)-[#7]-1-2)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-c1ccccc1)-[#6](=O)-[#7]-[#6](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1 |r|
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6@H]-2-[#6@@H](-[#6]-[#8]-[#6](=O)-[#7]-1-2)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1 |r|
[#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6@H]-2-[#6@@H](-[#6]-[#8]-[#6](=O)-[#7]-1-2)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#8]-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-c1ccccc1 |r|
CC(C)(C)c1cc(c(s1)NC(=O)Nc2cccc(c2Cl)Cl)C(=O)N3CCC(=O)N(CC3)CCN(C)C
C[C@@H]1CCC(CN1)N1CC[C@@]2(C1)CN(C(=O)c1cc3ccc(F)cc3[nH]1)c1ccccc21 |r|
CN1CCN(CC1)c1ccc(OC(F)(F)F)c(Nc2nccc(n2)-c2cc(cn2C)C(N)=O)c1
CN1CCN(CC1)c1ccc(OC(F)(F)F)c(Nc2nccc(n2)-c2cc3c(CCNC3=O)n2C)c1
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CCC[C@@H]3c3ccc(F)cc3)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3COC[C@@H]3c3ccc(F)cc3)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CCO[C@@H]3c3ccc(F)cc3)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CNC[C@@H]3c3ccc(F)cc3)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CCN[C@@H]3c3ccc(F)cc3)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CCN(C=O)[C@@H]3c3ccc(F)cc3)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CCN([C@@H]3c3ccc(F)cc3)C(C)=O)n2)c2c(N)ncnc12 |r|
CC(C)n1cc(C(=O)c2cncc(N[C@@H]3CCN([C@@H]3c3ccccc3)C(C)=O)n2)c2c(N)ncnc12 |r|
CC(=O)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](COC(C)=O)O[C@H]([C@H](OC(C)=O)[C@H]2OC(C)=O)n2[se]c3ccccc3c2=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |r|
CC(=O)OC[C@H]1O[C@@H](NC(=O)CCCn2[se]c3ccccc3c2=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |r|
OC[C@H]1O[C@@H](NC(=O)CCCn2[se]c3ccccc3c2=O)[C@H](O)[C@@H](O)[C@@H]1O |r|
Cn1c2c(C(C#N)C3(CCNCC3)NC2=O)c2ccc(Cl)c(Cl)c12
CN(C)CCn1cc(cn1)-c1ccn2c(cnc2c1)-c1ccc(C(N)=O)c(OCc2cccc(F)c2)c1
CCn1c(nc2cnc(Oc3cccc(NC(=O)c4ccc(OCCN5CCOCC5)cc4)c3)cc12)-c1nonc1N
CCn1c(nc2cncc(C(=O)N3CC[C@H](N)C3)c12)-c1nonc1N
COc1ccc(cc1)-c1ocnc1C(=O)NCc1ccncc1
CC(C)n1c2CCCC(=O)c2c2C(=O)c3ccccc3-c12
c1c2c-3c(c(c1O)O)OC(=O)c4c3c(c(c(c4)O)O)OC2=O
COc1cc2ncccc2cc1NC(=O)c1csc2cncnc12
CC1(C)OCC(=O)Nc2cc(Nc3nc(NCC(F)(F)F)c4occc4n3)ccc12
NC[C@@](O)(c1ccc(Cl)cc1)c1ccc(cc1)-c1cn[nH]c1
Nc1nc(NCCNc2ncc(c(n2)-c2ccc(Cl)cc2Cl)-n2ccnc2)ccc1[N+]([O-])=O
Nc1nc(NCCNc2ncc(-c3ncc[nH]3)c(n2)-c2ccc(Cl)cc2Cl)ccc1[N+]([O-])=O
Cc1c[nH]c(n1)c2cnc(nc2c3ccc(cc3Cl)Cl)NCCNc4ccc(cn4)C#N
NC(=O)[C@H](CCCCNC(=S)Nc1ccc(c(c1)C(O)=O)-c1c2ccc(O)cc2oc2cc(=O)ccc12)NC(=O)CN1C[C@H](Cc2ccccc2)NC(=O)CN(C[C@H](CCC(O)=O)NC(=O)CN(C[C@H](CCC(O)=O)NC(=O)CN(C[C@H](Cc2ccccc2)NC(=O)c2ccc(CSCCC1=O)cc2)C(=O)CCC1CCCCC1)C(=O)Cc1ccc2OCOc2c1)C(=O)CCC(O)=O |r|
O=C(N1CCOCC1)N1CCn2cc(C3=C(C(=O)NC3=O)c3cnc4ccccn34)c3cccc(C1)c23 |t:15|
CN(C)C(=O)N1CCn2cc(C3=C(C(=O)NC3=O)c3cnc4ccccn34)c3cccc(C1)c23 |t:11|
CC(C)OC(=O)N1CCn2cc(C3=C(C(=O)NC3=O)c3cnc4ccccn34)c3cccc(C1)c23 |t:12|
Cc1cc2CN(CCn3cc(C4=C(C(=O)NC4=O)c4cnc5ccccn45)c(c1)c23)C(=O)N1CCCCC1 |t:11|
O=C(N1CCCCC1)N1CCn2cc(C3=C(C(=O)NC3=O)c3cnc4ccccn34)c3cccc(C1)c23 |t:15|
c1ccn2c(c1)ncc2C3=C(C(=O)NC3=O)c4cn5c6c4cc(cc6CN(CC5)C(=O)N7CCCCC7)F
c1ccc2c(c1)nc(s2)C(C#N)c3ccnc(n3)NCCc4cccnc4
COc1ccc(cc1)N1Cc2cnc(Nc3ccc(F)cc3)nc2N(C2CC[C@@H](O)C2)C1=O
c1cc(ccc1C2=COc3cc(cc(c3C2=O)O)O)O
C[C@@H]1C[C@H]2CN1CCn1[nH]c3c(cccc3c1=O)-c1nc3c(O2)cccc3[nH]c1=O
CC(C)NCc1ccc(Nc2cc(n[nH]2)-c2ccc(cc2)-c2ccc(O)cc2O)cc1
Clc1cc2NC(=O)Nc3cnc(C#N)c(OCCCCOc2cc1NCc1cncs1)n3
N#CCc1ccc(cc1)-n1cnc2cnc3ccc(cc3c12)C#Cc1cccnc1
CC(C#N)c1ccc(cc1)-n1c(C)nc2cnc3ccc(cc3c12)C#Cc1cccnc1 |w:1.0|
CC(C#N)c1ccc(cc1)-n1cnc2cnc3ccc(cc3c12)C#Cc1cccnc1 |w:1.0|
CCc1nc2cnc3ccc(cc3c2n1-c1ccc(CC#N)cc1)C#Cc1cccnc1
Cn1c2cnc3ccc(cc3c2n(-c2ccc(cc2)C(C)(C)C#N)c1=O)C#Cc1cccnc1
Cc1nc2cnc3ccc(cc3c2n1-c1ccc(CC#N)cc1)C#Cc1cccnc1
Nc1ncnc2nc(-c3ccc(CN4CCC(CC4)c4cc(n[nH]4)-c4ccncc4)cc3)c(cc12)-c1ccccc1
Cc1nc2ccccc2n1C1CCN(Cc2ccc(cc2)-c2nc3ncnc(N)c3cc2-c2ccccc2)CC1
Nc1ncnc2n(cnc12)C1CCN(Cc2ccc(cc2)-c2nc3ncnc(N)c3cc2-c2ccccc2)CC1
Nc1ncnc2nc(-c3ccc(CN4CCC(CC4)n4c5ccccc5[nH]c4=O)cc3)c(cc12)-c1ccccc1
Nc1nc(N)c2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)n2c3ccccc3[nH]c2=O)cc1
Nc1[nH]c(=O)nc2nc(-c3ccc(CN4CCC(CC4)n4c5ccccc5[nH]c4=O)cc3)c(cc12)-c1ccccc1
Nc1nn(CCc2cnc[nH]2)c2nc(-c3ccc(CN4CCC(CC4)n4c5ccccc5[nH]c4=O)cc3)c(cc12)-c1ccccc1
Nc1nn(CCO)c2nc(-c3ccc(CN4CCC(CC4)n4c5ccccc5[nH]c4=O)cc3)c(cc12)-c1ccccc1
Cn1nc(N)c2cc(-c3ccccc3)c(nc12)-c1ccc(CN2CCC(CC2)n2c3ccccc3[nH]c2=O)cc1
Nc1n[nH]c2nc(-c3ccc(CN4CCC(CC4)n4c5ccccc5[nH]c4=O)cc3)c(cc12)-c1ccccc1
COc1nc(-c2ccc(CN3CCC(CC3)n3c4ccccc4[nH]c3=O)cc2)c(cc1C#N)-c1ccccc1
CN(C)c1nc(-c2ccc(CN3CCC(CC3)n3c4ccccc4[nH]c3=O)cc2)c(cc1C#N)-c1ccccc1
CNc1nc(-c2ccc(CN3CCC(CC3)n3c4ccccc4[nH]c3=O)cc2)c(cc1C#N)-c1ccccc1
Nc1nc(-c2ccc(CN3CCC(CC3)n3c4ccccc4[nH]c3=O)cc2)c(cc1C#N)-c1ccccc1
Clc1nc(-c2ccc(CN3CCC(CC3)n3c4ccccc4[nH]c3=O)cc2)c(cc1C#N)-c1ccccc1
C(N1CCC(CC1)c1cc(n[nH]1)-c1ccncc1)c1ccc(cc1)-c1nc2ncccc2cc1-c1ccccc1
CCN(CC)CCNC(=O)c1ccc2nc(-c3ccccc3)c(nc2c1)-c1ccc(CN2CCC(CC2)n2c3ccccc3[nH]c2=O)cc1
C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2cnccc2cc1-c1ccccc1
C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2ncccc2cc1-c1ccccc1
C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2ccncc2cc1-c1ccccc1
O=c1[nH]ccc2nc(-c3ccc(CN4CCC(CC4)c4nnc([nH]4)-c4ccccn4)cc3)c(cc12)-c1ccccc1
C(N1CCC(CC1)c1nnc([nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2cccnc2cc1-c1ccccc1
O=c1ccc(c[nH]1)-c1cc([nH]n1)C1CCN(Cc2ccc(cc2)-c2nc3ncccc3cc2-c2ccccc2)CC1
C(N1CCC(CC1)c1cc(n[nH]1)-c1ccccn1)c1ccc(cc1)-c1nc2ncccc2cc1-c1ccccc1
C(N1CCC(CC1)c1cc(n[nH]1)-c1cccnc1)c1ccc(cc1)-c1nc2ncccc2cc1-c1ccccc1
C(N1CCC(CC1)c1cc(n[nH]1)-c1ccncc1)c1ccc(cc1)-c1nc2ccccc2nc1-c1ccccc1
C(N1CCC(CC1)c1cc(n[nH]1)-c1ccccc1)c1ccc(cc1)-c1nc2ncccc2cc1-c1ccccc1
CCN(CC)CCNC(=O)c1ccc2nc(-c3ccc(CN4CCC(CC4)n4c5ccccc5[nH]c4=O)cc3)c(nc2c1)-c1ccccc1
Nc1nccn2c(nc(-c3ccc4ccc(nc4c3)-c3ccccc3)c12)[C@@H]1C[C@H](CN2CCC2)C1 |wU:26.30,28.33,(7.04,-25.52,;7.05,-27.06,;5.72,-27.83,;5.72,-29.37,;7.05,-30.15,;8.39,-29.37,;9.86,-29.85,;10.77,-28.6,;9.86,-27.34,;10.64,-26.02,;9.88,-24.69,;10.64,-23.36,;12.19,-23.36,;12.96,-22.02,;14.5,-22.04,;15.28,-23.37,;14.5,-24.71,;12.96,-24.7,;12.18,-26.03,;16.82,-23.38,;17.59,-24.72,;19.13,-24.72,;19.9,-23.38,;19.12,-22.05,;17.59,-22.05,;8.39,-27.82,;10.34,-31.32,;9.65,-32.69,;11.02,-33.38,;11.5,-34.85,;10.47,-35.99,;8.93,-36.07,;9.01,-37.61,;10.55,-37.53,;11.72,-32.01,)|
c1cc2cc(ccc2nc1)/C=C/3C(=O)N=C(S3)NCc4cccs4
Cc1ccc(cc1Nc1ncnc2n(ncc12)-c1ccccc1)C(=O)Nc1ccon1
Nc1nc(N)c2N=C(CCNc2n1)c1ccc(Cl)cc1 |c:6|
Nc1nc(N)c2N=C(CCNc2n1)c1cccc(Cl)c1 |c:6|
Nc1ncnc2NCCC(=Nc12)c1ccc(Cl)cc1 |c:9|
Nc1ncnc2NCCC(=Nc12)c1cccc(Cl)c1 |c:9|
Cc1ccc(cc1)C1=Nc2c(N)ncnc2NCC1 |t:8|
Nc1ncnc2NCCC(=Nc12)c1ccccc1 |c:9|
Cc1cccc(c1)C1=Nc2c(N)ncnc2NCC1 |t:8|
Nc1nc(N)c2N=C(CCNc2n1)c1ccccc1 |c:6|
CN(C)Cc1cccc(c1)-c1cc2c(Nc3ccc4[nH]ccc4c3C)c(cnc2s1)C#N
COc1cc2CCN(C(=O)CN(C)C)c2cc1Nc1nc(Nc2cccc3CNC(=O)c23)c2cc[nH]c2n1
COCC(=O)NC\C=C\c1ccc2ncnc(Nc3ccc(Oc4ccc(C)nc4)c(C)c3)c2c1
CCOc1cc2c(cc1NC(=O)/C=C/CN(C)C)c(c(cn2)C#N)Nc3ccc(c(c3)Cl)F
c1cc(c(c(c1)F)C(=O)n2c(nc(n2)Nc3ccc(cc3)S(=O)(=O)N)N)F
CC[C@H](CO)Nc1nc(NCc2ccccc2)c2ncn(C(C)C)c2n1 |r|
Oc1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
NC(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc2OCOc2c1)-c1ccccn1
C[C@]1(CCCN1c1nc(Nc2cc([nH]n2)C2CC2)c2cccn2n1)C(=O)Nc1ccc(F)nc1 |r|
COc1ccc2nc3[nH]nc(C)c3c(OC)c2c1
CC(C)CC(=O)Nc1[nH]nc2c1CN(C(=O)C1CCN(C)CC1)C2(C)C
CC(C)(C)C(=O)N1Cc2c(NC(=O)c3cc(F)cc(F)c3)[nH]nc2C1(C)C
O[C@H]1CC[C@@H](CC1)NC(=O)c1ccc-2c(Cc3c(n[nH]c-23)-c2ccc(cc2)-c2ccc(O)cc2)c1 |wU:4.7,wD:1.0,(19.77,-1.9,;21.02,-1.01,;22.42,-1.66,;23.69,-.77,;23.53,.76,;22.14,1.41,;20.89,.52,;24.79,1.65,;26.19,1.01,;26.33,-.53,;27.44,1.9,;27.3,3.44,;28.55,4.33,;29.95,3.7,;30.1,2.15,;31.61,1.81,;32.4,3.14,;33.83,3.77,;33.68,5.31,;32.16,5.65,;31.37,4.31,;35.16,2.99,;35.15,1.44,;36.46,.66,;37.81,1.42,;37.82,2.96,;36.49,3.74,;39.13,.64,;39.12,-.9,;40.44,-1.67,;41.78,-.91,;43.11,-1.69,;41.78,.63,;40.46,1.4,;28.85,1.26,)|
O=C1NCCc2[nH]c(cc12)-c1ccncc1
CCc1ccc(OC(C)=O)c(Cc2cc(CCCl)ccc2OC(C)=O)c1
CC[N@](Cc1cc(sn1)Nc2c3ncc(n3cc(n2)C)c4c[nH]nc4)C(C)(C)CO
C[C@@H]1CC(=O)Nc2ncnc(N3CCC(CC3)c3nc(cn3CCN3CCCC3)C3CCOCC3)c12 |r|
C[C@@H]1CC(=O)Nc2ncnc(N3CCC(CC3)c3nc(cn3CCN3CCCC3)-c3ccc(F)c(c3)C(F)(F)F)c12 |r|
C[C@@H]1CC(=O)Nc2ncnc(N3CCC(CC3)c3nc(cn3CCN3CCCC3)C(F)(F)F)c12 |r|
C[C@@H]1CC(=O)Nc2ncnc(N3CCC(CC3)c3nc(CCC(F)(F)F)cn3CCN3CCCC3)c12 |r|
CCc1[nH]nc2ncnc(N3CCN(CC3)c3cc(Cl)cc(NCCN(C)C)c3C)c12
CN(C)CCNc1cc(Cl)cc(N2CCN(CC2)c2ncnc3n[nH]c(Br)c23)c1C
CN(C)CCNc1cc(Cl)cc(N2CCN(CC2)c2ncnc3n[nH]c(c23)C(F)(F)F)c1C
CSc1ccccc1Nc2c3c(c(ncn3)NCC4CC4)nc(n2)N5CCNCC5
Clc1ccc(cc1)-c1ccc(o1)C(=O)Nc1ccc(cc1)N1CCNCC1
CC(C)COc1cc(NCCN2CCCC2)c(C)c(c1)N1CCN(CC1)c1ncnc2n[nH]c(Br)c12
CCc1[nH]nc2ncnc(N3CCN(CC3)c3cc(Cl)cc(NCCN4CCCC4)c3C)c12
Cc1c(NCCN2CCCC2)cc(Cl)cc1N1CCN(CC1)c1ncnc2n[nH]c(Br)c12
CCOc1cc(NCCN2CCCC2)c(C)c(c1)N1CCN(CC1)c1ncnc2n[nH]c(Br)c12
Cc1c(NCCN2CCCC2)cc(cc1N1CCN(CC1)c1ncnc2n[nH]c(Br)c12)C(=O)Nc1ccccc1
Cc1c(NCCN2CCCC2)cc(COCC(F)(F)F)cc1N1CCN(CC1)c1ncnc2n[nH]c(Br)c12
Cc1c(NCCN2CCCC2)cc(CCC(C)(C)C)cc1N1CCN(CC1)c1ncnc2n[nH]c(Br)c12
Cc1noc(n1)-c1cc(NCCN2CCCC2)c(C)c(c1)N1CCN(CC1)c1ncnc2n[nH]c(Br)c12
COC(=O)c1cc(NCCN2CCCC2)c(C)c(c1)N1CCN(CC1)c1ncnc2n[nH]c(Br)c12
CCC(=O)c1cc(NCCN2CCCC2)c(C)c(c1)N1CCN(CC1)c1ncnc2n[nH]c(Br)c12
Cc1c(NCCN2CCCC2)cc(cc1N1CCN(CC1)c1ncnc2n[nH]c(Br)c12)C(=O)CCC(F)(F)F
COc1ccc2c(Oc3ccc(NC(=O)c4c(C)n(CC(C)(C)O)n(-c5ccccc5)c4=O)nc3)ccnc2c1
CC1=C(C(=O)N(N1C)c2ccccc2)C(=O)Nc3ccc(c(c3)F)Oc4ccnc5c4cc(c(c5)OC)OC
NC1(CCC1)c1ccc(cc1)-c1c(ccc2ccnn12)-c1ccccc1
NC(=O)c1cnc(-c2ccc(cc2)C2(N)CCC2)c(c1)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-n1c(nc2ccccc2c1=O)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2ccccc2c(=O)n1-c1ccccc1
Cn1cnc2c(-c3ccc(cc3)C3(N)CCC3)c(ccc12)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1c(ccc2ncnn12)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1c(ccn2ncnc12)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1c(ncc2nccn12)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1c(ccn2ccnc12)-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1ncc2cccnc2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1ncc2ccncc2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1ncc2cnccc2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1ncc2ncccc2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1ncc2ccccc2c1-c1ccccc1
CCn1cnc2cnc(-c3ccc(cc3)C3(N)CCC3)c(-c3ccccc3)c12
NC1(CCC1)c1ccc(cc1)-c1ncc2nccn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1ncc2cccn2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nn2ccc(=O)nc2cc1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nn2ccccc2c1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nn2cccc2cc1-c1ccccc1
NC1(CCC1)c1ccc(cc1)-c1nc2ccccc2cc1-c1ccccc1
Cn1c(nc2ccccc12)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1
Cn1c(nc2ccccc12)-c1ccnc(Nc2ccccc2)n1
Cc1ccc(Nc2nccc(n2)-c2nc3ccccc3n2C)cc1
Cn1c(nc2ccccc12)-c1ccnc(Nc2ccc(Cl)cc2)n1
Cn1c(nc2ccccc12)-c1ccnc(Nc2ccc(O)cc2)n1
CCOc1ccc(Nc2nccc(n2)-c2nc3ccccc3n2C)cc1
COc1ccc(Nc2nccc(n2)-c2nc3ccccc3n2C)cc1
Cn1c(nc2ccccc12)-c1ccnc(Nc2cccc(O)c2)n1
Cn1c(nc2ccccc12)-c1ccnc(Nc2ccc(O)c(Cl)c2)n1
COc1ccc(Nc2nccc(n2)-c2nc3ccccc3n2C)cc1O
Cn1c(nc2ccccc12)-c1ccc2c(n1)n(C)c(=O)n(C)c2=O
COc1ccc(Nc2ncc3CC(=O)Nc4ccccc4-c3n2)cc1O
[#6]-[#8]-c1cc(\[#6]=[#6](/[#6](=O)/[#6]=[#6]/c2cccc(-[#8]-[#6])c2-[#8]-[#6])-[#6](=O)\[#6]=[#6]\c2cccc(-[#8]-[#6])c2-[#8]-[#6])ccc1-[#8]
[#6]-[#8]-c1ccc(-[#8]-[#6])c(\[#6]=[#6]\[#6](=O)-[#6](=[#6]/c2cc(Br)c(-[#8])c(-[#8]-[#6])c2)\[#6](=O)\[#6]=[#6]\c2cc(-[#8]-[#6])ccc2-[#8]-[#6])c1
[#6]-[#8]-c1ccc(\[#6]=[#6]\[#6](=O)-[#6](=[#6]/c2ccc(-[#8]-[#6])c(-[#8])c2)\[#6](=O)\[#6]=[#6]\c2ccc(-[#8]-[#6])cc2-[#8]-[#6])c(-[#8]-[#6])c1
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1cccc(F)c1F
CNC(=O)c1nc(cnc1N)-c1ccc(Cl)c(c1)S(=O)(=O)Nc1cccc(F)c1C
Nc1ncccc1-c1nc2cc(cnc2n1-c1ccc(CNC(=O)c2ccccc2)cc1)-c1ccccc1
Nc1ncccc1-c1nc2cc(cnc2n1-c1ccc(CNC(=O)c2ccccc2)cc1)-c1cccnc1
NCc1ccc(cc1)-n1c(nc2cccnc12)-c1cccnc1N
CC(=O)Nc1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(CNC(=O)c4ccccc4)cc3)c2n1
Nc1ncccc1-c1nc2cc(cnc2n1-c1ccc(CNC(=O)c2cccc(F)c2)cc1)-c1cccnc1
CC(=O)NCc1ccc(cc1)-n1c(nc2cccnc12)-c1cccnc1N
Nc1ccc(cc1)-n1c(nc2cccnc12)-c1cccnc1N
Nc1ncccc1-c1nc2ccc(nc2n1-c1ccc(CNC(=O)c2ccccc2)cc1)-c1cccnc1
Nc1ncccc1-c1nc2ccc(nc2n1-c1ccc(CNC(=O)c2cccc(F)c2)cc1)-c1cccnc1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CNC(=O)Cc2ccccc2)cc1
Nc1ncccc1-c1nc2ccc(nc2n1-c1ccc(CC(=O)Nc2ccccc2)cc1)-c1cccnc1
Nc1ncccc1-c1nc2ccc(nc2n1-c1ccc(CNC(=O)c2ccccc2)cc1)-c1ccccc1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CNC(=O)c2ccccc2)cc1
CC(=O)Nc1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(CC(=O)Nc4ccccc4)cc3)c2n1
Nc1ncccc1-c1nc2cc(cnc2n1-c1ccc(CNC(=O)c2ccccc2)cc1)C1CCCC1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CNCc2ccccc2)cc1
CC(=O)Nc1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(CC(=O)Nc4cccc(F)c4)cc3)c2n1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CNC(=O)C2CCCCC2)cc1
CC(=O)Nc1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(CNC(=O)c4cccc(F)c4)cc3)c2n1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(CC(=O)Nc2ccccc2)cc1
Nc1ncccc1-c1nc2cc(Br)cnc2n1-c1ccc(CNC(=O)c2ccccc2)cc1
Nc1ncccc1-c1nc2cccnc2n1-c1ccc(NC(=O)c2ccccc2)cc1
CC(C)(C)c1cccc(c1)-n1c(nc2cccnc12)-c1cccnc1N
CC(C)(C)c1ccc(cc1)-n1c(nc2cc(Br)cnc12)-c1cccnc1N
COc1ccccc1Cn1c(nc2cc(Br)cnc12)-c1ccncc1
COc1ccccc1Cn1c(nc2cc(Br)cnc12)-c1cccnc1N
CC(C)(C)c1ccc(cc1)-n1c(nc2cccnc12)-c1ccncc1
CC(C)(C)c1ccc(cc1)-n1c(nc2cccnc12)-c1cccnc1
COc1ccccc1Cn1c(nc2cccnc12)-c1cccnc1N
Nc1ncccc1-c1nc2cccnc2n1-c1cccc(CNC(=O)c2ccccc2)c1
NCc1ccc(cc1)-n1c(nc2cccnc12)-c1cccnc1
Nc1ncnc2n(cnc12)C1OC(COP([O-])(=O)OP([NH-])(=O)OP([O-])([O-])=O)C(O)C1O
CC(C)(C)c1ccc(cc1)-n1c(nc2cccnc12)-c1cccnc1N
CC(=O)Nc1ccc(cc1)-n1c(nc2cccnc12)-c1cccnc1N
C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(CC3)C(=O)[C@H](CNCC(F)(F)F)c3ccc(Cl)cc3)c12 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2CCC(C)(C)c12)c1ccc(Cl)cc1 |r|
CN1CCN(CC1)c2ccc(cc2)Nc3ncc4c(n3)n(c(n4)Nc5ccccc5)C6CCCC6
CC(C)(C)Nc1c(Nc2ccnc(Nc3ccc(cc3)-c3ccncc3)n2)c(=O)c1=O
C[C@H]1O[C@H](C[C@H]([C@@H]1O)N(C)C)c1ccc2C(=O)C3=C([C@@H](C)O[C@@H]4CC(=O)O[C@H]34)C(=O)c2c1O |r,t:18|
COC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccccc1
COC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccc(C)cc1
CCOC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1cccc(OC)c1
COC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccc(F)cc1
CCOC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccc(F)cc1
CCOC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccc(OC)cc1
CCOC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccc(OC)c(OC)c1
CCOC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccc(C)cc1
CCOC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1CC(C)C
COC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccc(OC)cc1
COC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1cccc(OC)c1
COC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccc(OC)c(OC)c1
CCOC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccccc1F
CCOC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccccc1
COC(=O)c1c(C)nc(NNC(=O)c2cccc3c2[nH]c2ccccc2c3=O)nc1-c1ccccc1F
CN1CCN(CC1)C(C(=O)N1CCN(CC1)c1ncnc2[nH]cc(Br)c12)c1ccc(Cl)cc1
CN(C1CCN(CC1)c1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(cc3)C3(N)CCC3)c2n1)C(C)=O
Cc1nc(-c2ccc(CN3CCC(CC3)n3c4cc(NC(=O)C=C)ccc4[nH]c3=O)cc2)c([nH]c1=O)-c1ccccc1
Cc1nc(-c2ccccc2)c([nH]c1=O)-c1ccc(CN2CCC(CC2)n2c3cc(NC(=O)C=C)ccc3[nH]c2=O)cc1
[H][C@@](CN)(Cc1cccc(F)c1)NC(=O)c1cc(c(Cl)s1)-c1c(Cl)cnn1C |r,wU:1.1,wD:1.0,(11.52,-5.94,;10.83,-4.68,;10.06,-6.01,;10.83,-7.35,;12.17,-3.88,;13.49,-4.64,;13.48,-6.2,;14.82,-6.95,;16.15,-6.19,;16.19,-4.64,;17.46,-3.84,;14.79,-3.91,;9.41,-3.84,;8.08,-4.6,;8.11,-6.13,;6.85,-3.92,;5.41,-4.51,;4.4,-3.4,;5.15,-2.04,;4.33,-.64,;6.62,-2.35,;2.85,-3.54,;1.85,-2.41,;2.36,-.88,;.42,-3.01,;.5,-4.52,;2.04,-4.83,;2.44,-6.32,)|
c1cc(c(cc1Cl)CNc2ncc(c(n2)NC3CCCC3)C(=O)NCCCN4CCOC4=O)Cl
Clc1ccc(Cl)c(CNc2ncc(C(=O)NCCCN3CCCC3=O)c(NC3CCCC3)n2)c1
COc1ccccc1CNc2ncc(c(n2)NC3CCCC3)C(=O)NCCCN4CCCC4=O
COc1ccc(CCNc2ncc(C(=O)NCCCN3CCCC3=O)c(NC3CCCC3)n2)cc1OC
CN(C)C1CCC(CC1)Nc1nc(Nc2cc(Cl)cc(Cl)c2)ncc1-c1cc(C)no1 |(9.04,-43.08,;10.39,-42.35,;11.7,-43.16,;10.44,-40.81,;9.13,-40,;9.18,-38.46,;10.53,-37.74,;11.85,-38.53,;11.8,-40.08,;10.57,-36.2,;9.81,-34.87,;8.27,-34.86,;7.51,-33.53,;5.96,-33.52,;5.2,-32.19,;5.97,-30.85,;5.21,-29.52,;5.98,-28.19,;3.67,-29.52,;2.89,-30.86,;1.35,-30.86,;3.66,-32.19,;8.27,-32.2,;9.8,-32.19,;10.58,-33.53,;12.11,-33.53,;12.6,-34.99,;14.14,-34.99,;15.06,-36.23,;14.61,-33.52,;13.35,-32.62,)|
CN1CCC(CC1)NC(=O)c1cnc(Nc2cc(Cl)cc(Cl)c2)nc1N[C@@H]1COC[C@H]1O |r|
CN(C)C1CCC(CC1)Nc1nc(Nc2cc(Cl)cc(Cl)c2)ncc1C(=O)NC1CCN(C)CC1 |(47.36,-51.36,;48.9,-51.37,;49.67,-52.7,;49.68,-50.04,;48.92,-48.7,;49.7,-47.37,;51.23,-47.39,;52.01,-48.71,;51.22,-50.05,;52,-46.06,;51.24,-44.72,;49.7,-44.72,;48.94,-43.38,;47.4,-43.38,;46.63,-42.04,;47.41,-40.71,;46.64,-39.37,;47.41,-38.04,;45.1,-39.37,;44.33,-40.71,;42.79,-40.71,;45.1,-42.04,;49.7,-42.05,;51.24,-42.05,;52.01,-43.39,;53.55,-43.39,;54.32,-44.72,;54.32,-42.06,;55.86,-42.06,;56.62,-43.39,;58.16,-43.4,;58.94,-42.07,;60.48,-42.08,;58.17,-40.73,;56.62,-40.72,)|
CN1CCC(CC1)NC(=O)c1cnc(NCc2cc(Cl)ccc2Cl)nc1NC1CCCC1
COc1ccccc1CNc1ncc(C(=O)NC2CCN(C)CC2)c(NC2CCCC2)n1
COc1ccc(cc1OC)C(C)NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12
CC(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccc(cc1)S(C)(=O)=O
CC(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1ccccn1
CC(NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)c1cccnc1
c1cc(ccc1CNC(=O)C2(CCN(CC2)c3c4cc[nH]c4ncn3)N)Cl
Oc1ccc(CCNC(=O)C(Cc2cc(Br)c(O)c(c2)-c2cc(CC(N=O)C(=O)NCCc3ccc(O)c(Br)c3)cc(Br)c2O)N=O)cc1Br
Cc1c(F)c(ccc1C(=O)N1CCOc2ccc(cc2C1)-c1ccc(N)nc1)S(C)(=O)=O
CN1c2ccc(NCc3ccc(cc3)C(C)(C)C)cc2-c2c(cnn2C)S1(=O)=O
CCc1ccc(cc1)-c1ccc2N(C)S(=O)(=O)c3cnn(C)c3-c2c1
CCc1ccc(cc1)-c1ccc2N(C)S(=O)(=O)c3c[nH]nc3-c2c1
CN1C[C@H](Cc2ccccn2)C(=O)C(C1)=Cc1ccccn1 |r,w:15.17|
CN1C[C@@H](Cc2ccccn2)C(=O)C(C1)=Cc1ccccn1 |r,w:15.17|
O=C1\C(CSC\C1=C/c1ccccn1)=C\c1ccccn1
CN1C\C(=C/c2ccccn2)C(=O)\C(C1)=C\c1ccccn1
O=C1\C(CNC\C1=C/c1ccccn1)=C\c1ccccn1
Fc1ccccc1\C=C1/CNC\C(=C/c2ccccc2F)C1=O
CNc1nc(C)c(s1)-c1nc(Nc2cccc(c2)N2CCCNCC2)ncc1C#N
CCCCCCCCCCCCCCCCCCOCC(COP([O-])(=O)OCC[N+](C)(C)C)OC
CCCCCCCCCCCCCCCCOP([O-])(=O)OCC[N+](C)(C)C
CCCCCCCCCCCCCCCCCCCCCC[C@]1(CCC[C@@H]1OP([O-])(=O)OCC[N+](C)(C)C)C(=O)OCC |r|
CCCCCCCCCCCCCCCCCCCC[C@]1(CCC[C@@H]1OP([O-])(=O)OCC[N+](C)(C)C)C(=O)OCC |r|
CCCCCCCCCCCCCCCCCC[C@]1(CCC[C@@H]1OP([O-])(=O)OCC[N+](C)(C)C)C(=O)OCC |r|
CCCCCCCCCCCCCCCC[C@]1(CCC[C@@H]1OP([O-])(=O)OCC[N+](C)(C)C)C(=O)OCC |r|
CCCCCCCCCCCCC[C@]1(CCC[C@@H]1OP([O-])(=O)OCC[N+](C)(C)C)C(=O)OCC |r|
CCCCCCCCCCCCCCCCCCCCCC[C@]1(CCC[C@H]1OP([O-])(=O)OCC[N+](C)(C)C)C(=O)OCC |r|
CCCCCCCCCCCCCCCCCCCC[C@]1(CCC[C@H]1OP([O-])(=O)OCC[N+](C)(C)C)C(=O)OCC |r|
CCCCCCCCCCCCCCCCCC[C@]1(CCC[C@H]1OP([O-])(=O)OCC[N+](C)(C)C)C(=O)OCC |r|
CCCCCCCCCCCCCCCC[C@]1(CCC[C@H]1OP([O-])(=O)OCC[N+](C)(C)C)C(=O)OCC |r|
CCCCCCCCCCCCC[C@]1(CCC[C@H]1OP([O-])(=O)OCC[N+](C)(C)C)C(=O)OCC |r|
[O-][N+](=O)c1ccccc1-c1n[nH]cc1C=C1C(=O)Nc2ccccc12 |w:14.15|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCCO)c1=O |r,wU:19.20,wD:22.27,(7.3,4.56,;5.97,5.33,;4.64,4.56,;3.3,5.33,;1.97,4.56,;1.97,3.02,;3.3,2.25,;4.64,3.02,;.64,2.25,;-.7,3.02,;-2.03,2.25,;-3.37,3.02,;-3.37,4.56,;-4.7,2.25,;-4.7,.71,;-6.03,-.06,;-3.37,-.06,;-2.03,.71,;-.7,-.06,;-.7,-1.6,;.64,-2.37,;.64,-3.91,;-.7,-4.68,;-2.03,-3.91,;-2.03,-2.37,;-.7,-6.22,;.64,-6.99,;.64,-8.53,;1.97,-9.3,;.64,.71,;1.97,-.06,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCC(N)=O)c(=O)c(cc12)-c1cnc2ccccc2c1 |r,wU:11.14,wD:8.7,(66.59,-45.15,;66.6,-46.69,;65.27,-47.46,;65.26,-49,;63.93,-49.77,;66.6,-49.77,;67.93,-49.01,;69.27,-49.78,;69.26,-51.32,;67.92,-52.08,;67.91,-53.62,;69.24,-54.4,;70.58,-53.63,;70.59,-52.09,;69.23,-55.94,;67.89,-56.7,;66.56,-55.92,;65.22,-56.68,;66.57,-54.38,;70.62,-49.01,;71.95,-49.78,;70.62,-47.46,;69.27,-46.67,;67.93,-47.45,;71.96,-46.7,;73.29,-47.47,;74.62,-46.71,;74.62,-45.17,;75.95,-44.41,;75.96,-42.86,;74.62,-42.09,;73.29,-42.86,;73.29,-44.39,;71.96,-45.16,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCC(N)=O)c(=O)c(cc12)-c1cnn(C)c1 |r,wU:11.14,wD:8.7,(54.35,-45.06,;54.35,-46.6,;53.02,-47.37,;53.02,-48.92,;51.69,-49.69,;54.36,-49.69,;55.69,-48.92,;57.02,-49.7,;57.02,-51.23,;55.68,-52,;55.67,-53.53,;57,-54.31,;58.34,-53.55,;58.35,-52,;56.99,-55.85,;55.65,-56.61,;54.32,-55.83,;52.98,-56.6,;54.33,-54.29,;58.37,-48.93,;59.71,-49.7,;58.38,-47.37,;57.03,-46.59,;55.69,-47.37,;59.71,-46.61,;61.11,-47.25,;62.14,-46.12,;61.39,-44.78,;62.02,-43.38,;59.88,-45.09,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCC(N)=O)c(=O)c(cc12)-c1cn[nH]c1 |r,wU:11.14,wD:8.7,(44.02,-44.59,;44.03,-46.13,;42.7,-46.9,;42.69,-48.44,;41.36,-49.21,;44.03,-49.21,;45.36,-48.45,;46.7,-49.22,;46.69,-50.76,;45.35,-51.52,;45.34,-53.06,;46.67,-53.84,;48.01,-53.07,;48.02,-51.53,;46.66,-55.38,;45.32,-56.14,;43.99,-55.36,;42.65,-56.12,;44,-53.82,;48.05,-48.45,;49.38,-49.23,;48.05,-46.9,;46.7,-46.11,;45.36,-46.89,;49.39,-46.14,;50.78,-46.78,;51.82,-45.64,;51.06,-44.31,;49.55,-44.61,)|
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCC(N)=O)c1=O |r,wU:22.27,wD:19.20,(40.72,-44.52,;39.39,-43.75,;38.06,-44.52,;38.05,-46.06,;36.72,-46.82,;35.39,-46.05,;35.39,-44.51,;36.72,-43.74,;34.05,-46.8,;32.7,-46.02,;31.36,-46.8,;30.03,-46.04,;30.02,-44.5,;28.7,-46.81,;28.7,-48.35,;27.36,-49.12,;30.03,-49.12,;31.36,-48.35,;32.7,-49.13,;32.69,-50.67,;31.35,-51.43,;31.34,-52.96,;32.67,-53.74,;34.01,-52.98,;34.02,-51.44,;32.66,-55.28,;31.32,-56.04,;29.99,-55.26,;28.66,-56.03,;30,-53.73,;34.05,-48.36,;35.38,-49.13,)|
COc1ncc(cc1F)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCC(N)=O)c1=O |r,wU:23.28,wD:20.21,(27.28,-44.28,;25.95,-43.51,;24.61,-44.28,;24.61,-45.82,;23.27,-46.58,;21.94,-45.81,;21.94,-44.27,;23.27,-43.5,;23.27,-41.96,;20.6,-46.56,;19.26,-45.78,;17.92,-46.56,;16.58,-45.8,;16.58,-44.26,;15.25,-46.57,;15.25,-48.11,;13.92,-48.88,;16.58,-48.88,;17.91,-48.12,;19.25,-48.89,;19.24,-50.43,;17.9,-51.19,;17.9,-52.72,;19.22,-53.51,;20.56,-52.74,;20.57,-51.2,;19.21,-55.04,;17.88,-55.81,;16.55,-55.03,;15.21,-55.79,;16.56,-53.49,;20.6,-48.12,;21.93,-48.89,)|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCC(N)=O)c1=O |r,wU:22.27,wD:19.20,(13.86,-44.58,;12.52,-43.81,;11.19,-44.58,;9.85,-43.81,;8.52,-44.58,;8.52,-46.11,;9.85,-46.88,;11.18,-46.12,;7.18,-46.87,;5.83,-46.08,;4.49,-46.86,;3.16,-46.1,;3.16,-44.56,;1.83,-46.87,;1.83,-48.41,;.5,-49.18,;3.16,-49.18,;4.49,-48.42,;5.83,-49.19,;5.82,-50.73,;4.48,-51.49,;4.48,-53.02,;5.8,-53.81,;7.14,-53.04,;7.15,-51.5,;5.79,-55.34,;4.45,-56.11,;3.13,-55.33,;1.79,-56.09,;3.14,-53.79,;7.18,-48.42,;8.51,-49.19,)|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCC(N)=O)c(=O)c(cc12)-c1cnc2ccccc2c1 |r,wD:8.7,11.14,(67.89,-30.91,;67.89,-32.45,;66.56,-33.22,;66.56,-34.76,;65.23,-35.53,;67.9,-35.53,;69.23,-34.77,;70.56,-35.54,;70.56,-37.08,;71.89,-37.85,;71.88,-39.39,;70.54,-40.16,;69.21,-39.38,;69.22,-37.84,;70.53,-41.7,;69.19,-42.46,;67.86,-41.68,;66.52,-42.44,;67.87,-40.14,;71.91,-34.77,;73.24,-35.54,;71.91,-33.21,;70.57,-32.43,;69.23,-33.21,;73.25,-32.46,;74.59,-33.23,;75.92,-32.47,;75.92,-30.93,;77.25,-30.16,;77.25,-28.62,;75.91,-27.85,;74.59,-28.62,;74.58,-30.15,;73.25,-30.92,)|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCC(N)=O)c(=O)c(cc12)-c1cnn(C)c1 |r,wD:8.7,11.14,(54.57,-30.85,;54.57,-32.39,;53.24,-33.16,;53.24,-34.71,;51.91,-35.48,;54.58,-35.48,;55.9,-34.71,;57.24,-35.49,;57.24,-37.03,;58.57,-37.79,;58.56,-39.34,;57.22,-40.1,;55.89,-39.32,;55.9,-37.79,;57.21,-41.64,;55.87,-42.4,;54.54,-41.63,;53.2,-42.39,;54.55,-40.09,;58.59,-34.72,;59.92,-35.49,;58.59,-33.16,;57.25,-32.38,;55.91,-33.16,;59.93,-32.4,;61.32,-33.04,;62.36,-31.91,;61.61,-30.57,;62.24,-29.17,;60.1,-30.88,)|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCC(N)=O)c(=O)c(cc12)-c1cn[nH]c1 |r,wD:8.7,11.14,(43.18,-30.37,;43.19,-31.91,;41.86,-32.68,;41.85,-34.23,;40.52,-34.99,;43.19,-35,;44.52,-34.23,;45.86,-35.01,;45.85,-36.54,;47.18,-37.31,;47.17,-38.86,;45.83,-39.62,;44.5,-38.84,;44.51,-37.31,;45.82,-41.16,;44.48,-41.92,;43.15,-41.14,;41.81,-41.9,;43.16,-39.6,;47.21,-34.23,;48.54,-35.01,;47.21,-32.68,;45.86,-31.89,;44.52,-32.67,;48.55,-31.92,;49.94,-32.56,;50.98,-31.43,;50.22,-30.09,;48.71,-30.4,)|
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@@H](CC2)OCC(N)=O)c1=O |r,wD:19.20,22.27,(40.28,-30.68,;38.94,-29.91,;37.61,-30.68,;37.6,-32.22,;36.27,-32.99,;34.94,-32.21,;34.94,-30.68,;36.27,-29.91,;33.6,-32.97,;32.25,-32.19,;30.91,-32.97,;29.58,-32.2,;29.57,-30.66,;28.25,-32.97,;28.25,-34.52,;26.91,-35.28,;29.58,-35.29,;30.91,-34.52,;32.25,-35.3,;32.24,-36.83,;33.57,-37.6,;33.56,-39.15,;32.22,-39.91,;30.89,-39.13,;30.9,-37.6,;32.21,-41.45,;30.87,-42.21,;29.55,-41.43,;28.21,-42.19,;29.56,-39.89,;33.6,-34.52,;34.93,-35.3,)|
COc1ncc(cc1F)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@@H](CC2)OCC(N)=O)c1=O |r,wD:20.21,23.28,(27.43,-30.66,;26.1,-29.89,;24.76,-30.66,;24.76,-32.2,;23.42,-32.96,;22.09,-32.19,;22.09,-30.65,;23.42,-29.88,;23.42,-28.34,;20.75,-32.94,;19.4,-32.16,;18.06,-32.94,;16.73,-32.18,;16.73,-30.64,;15.4,-32.95,;15.4,-34.49,;14.07,-35.26,;16.73,-35.26,;18.06,-34.49,;19.4,-35.27,;19.39,-36.81,;20.72,-37.58,;20.71,-39.12,;19.37,-39.88,;18.05,-39.1,;18.05,-37.57,;19.36,-41.42,;18.02,-42.18,;16.7,-41.41,;15.36,-42.17,;16.71,-39.87,;20.75,-34.5,;22.08,-35.27,)|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@@H](CC2)OCC(N)=O)c1=O |r,wD:19.20,22.27,(14.55,-30.27,;13.22,-29.49,;11.88,-30.26,;10.54,-29.49,;9.21,-30.26,;9.21,-31.79,;10.54,-32.57,;11.88,-31.8,;7.87,-32.55,;6.53,-31.77,;5.19,-32.55,;3.85,-31.78,;3.85,-30.24,;2.52,-32.55,;2.52,-34.1,;1.19,-34.87,;3.86,-34.87,;5.19,-34.1,;6.52,-34.88,;6.51,-36.41,;7.85,-37.18,;7.83,-38.73,;6.5,-39.49,;5.17,-38.71,;5.18,-37.18,;6.49,-41.03,;5.15,-41.79,;3.82,-41.01,;2.48,-41.77,;3.83,-39.47,;7.87,-34.1,;9.2,-34.88,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCO)c(=O)c(cc12)-c1cnc2ccccc2c1 |r,wU:11.14,wD:8.7,(65.77,-15.8,;65.77,-17.34,;64.44,-18.11,;64.44,-19.65,;63.11,-20.42,;65.77,-20.42,;67.1,-19.65,;68.44,-20.43,;68.43,-21.96,;67.09,-22.73,;67.09,-24.26,;68.41,-25.04,;69.75,-24.28,;69.76,-22.73,;68.4,-26.58,;67.07,-27.34,;65.74,-26.56,;69.79,-19.66,;71.12,-20.43,;69.79,-18.1,;68.45,-17.32,;67.11,-18.1,;71.13,-17.34,;72.46,-18.12,;73.8,-17.36,;73.79,-15.82,;75.12,-15.05,;75.13,-13.51,;73.79,-12.74,;72.46,-13.51,;72.46,-15.04,;71.13,-15.81,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCO)c(=O)c(cc12)-c1cnn(C)c1 |r,wU:11.14,wD:8.7,(54.37,-15.83,;54.38,-17.37,;53.05,-18.15,;53.05,-19.69,;51.71,-20.46,;54.38,-20.46,;55.71,-19.69,;57.05,-20.47,;57.04,-22.01,;55.7,-22.77,;55.69,-24.3,;57.02,-25.08,;58.36,-24.32,;58.37,-22.78,;57.01,-26.62,;55.67,-27.39,;54.34,-26.61,;58.4,-19.7,;59.73,-20.47,;58.4,-18.14,;57.05,-17.36,;55.71,-18.14,;59.74,-17.38,;61.13,-18.03,;62.17,-16.89,;61.41,-15.55,;62.05,-14.15,;59.9,-15.86,)|
Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCO)c(=O)c(cc12)-c1cn[nH]c1 |r,wU:11.14,wD:8.7,(43.23,-15.53,;43.23,-17.07,;41.9,-17.84,;41.9,-19.39,;40.57,-20.15,;43.23,-20.16,;44.56,-19.39,;45.9,-20.17,;45.89,-21.7,;44.56,-22.47,;44.55,-24,;45.88,-24.78,;47.21,-24.02,;47.23,-22.47,;45.87,-26.32,;44.53,-27.08,;43.2,-26.3,;47.25,-19.39,;48.58,-20.17,;47.25,-17.84,;45.91,-17.05,;44.57,-17.83,;48.59,-17.08,;49.98,-17.72,;51.02,-16.59,;50.26,-15.25,;48.76,-15.56,)|
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCO)c1=O |r,wU:22.27,wD:19.20,(39.75,-16,;38.42,-15.23,;37.08,-15.99,;37.08,-17.53,;35.75,-18.3,;34.41,-17.52,;34.42,-15.99,;35.74,-15.22,;33.08,-18.28,;31.73,-17.5,;30.39,-18.28,;29.05,-17.51,;29.05,-15.97,;27.73,-18.28,;27.72,-19.83,;26.39,-20.6,;29.06,-20.6,;30.39,-19.83,;31.72,-20.61,;31.72,-22.14,;30.38,-22.91,;30.37,-24.44,;31.7,-25.22,;33.04,-24.46,;33.05,-22.91,;31.69,-26.76,;30.35,-27.52,;29.02,-26.74,;33.07,-19.84,;34.4,-20.61,)|
COc1ncc(cc1F)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCO)c1=O |r,wU:23.28,wD:20.21,(26.25,-15.63,;24.91,-14.86,;23.58,-15.63,;23.58,-17.17,;22.24,-17.93,;20.91,-17.16,;20.91,-15.63,;22.24,-14.86,;22.24,-13.32,;19.57,-17.92,;18.23,-17.13,;16.89,-17.91,;15.55,-17.15,;15.55,-15.61,;14.22,-17.92,;14.22,-19.46,;12.89,-20.23,;15.55,-20.23,;16.88,-19.47,;18.22,-20.24,;18.21,-21.78,;16.88,-22.54,;16.87,-24.07,;18.19,-24.86,;19.53,-24.09,;19.54,-22.55,;18.18,-26.39,;16.85,-27.16,;15.52,-26.38,;19.57,-19.47,;20.9,-20.24,)|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCO)c(=O)c(cc12)-c1cnc2ccccc2c1 |r,wD:8.7,11.14,(3.1,-15.67,;3.11,-17.2,;1.78,-17.98,;1.78,-19.52,;.44,-20.29,;3.11,-20.29,;4.44,-19.52,;5.78,-20.3,;5.77,-21.84,;7.1,-22.6,;7.09,-24.15,;5.75,-24.91,;4.42,-24.13,;4.43,-22.6,;5.74,-26.45,;4.4,-27.21,;3.07,-26.43,;7.12,-19.53,;8.46,-20.3,;7.13,-17.97,;5.78,-17.19,;4.44,-17.97,;8.47,-17.21,;9.8,-17.99,;11.13,-17.23,;11.13,-15.69,;12.46,-14.92,;12.47,-13.38,;11.12,-12.61,;9.8,-13.38,;9.8,-14.91,;8.47,-15.68,)|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCO)c(=O)c(cc12)-c1cnn(C)c1 |r,wD:8.7,11.14,(66.3,-1.69,;66.31,-3.23,;64.98,-4,;64.98,-5.54,;63.64,-6.31,;66.31,-6.31,;67.64,-5.55,;68.98,-6.32,;68.97,-7.86,;70.3,-8.63,;70.29,-10.17,;68.95,-10.94,;67.62,-10.16,;67.63,-8.62,;68.94,-12.48,;67.6,-13.24,;66.27,-12.46,;70.33,-5.55,;71.66,-6.32,;70.33,-3.99,;68.98,-3.21,;67.64,-3.99,;71.67,-3.24,;73.06,-3.88,;74.1,-2.74,;73.34,-1.4,;73.98,-0,;71.83,-1.71,)|
Cc1nc(N)nc2n([C@@H]3CC[C@@H](CC3)OCO)c(=O)c(cc12)-c1cn[nH]c1 |r,wD:8.7,11.14,(55.51,-1.14,;55.51,-2.68,;54.18,-3.45,;54.18,-5,;52.85,-5.77,;55.52,-5.77,;56.85,-5,;58.18,-5.78,;58.18,-7.31,;59.51,-8.08,;59.5,-9.63,;58.16,-10.39,;56.83,-9.61,;56.84,-8.08,;58.15,-11.93,;56.81,-12.69,;55.48,-11.91,;59.53,-5.01,;60.86,-5.78,;59.53,-3.45,;58.19,-2.67,;56.85,-3.45,;60.87,-2.69,;62.26,-3.33,;63.3,-2.2,;62.55,-.86,;61.04,-1.17,)|
COc1ncc(cn1)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@@H](CC2)OCO)c1=O |r,wD:19.20,22.27,(52.42,-2.69,;51.08,-1.92,;49.75,-2.69,;49.75,-4.23,;48.41,-4.99,;47.08,-4.21,;47.08,-2.68,;48.41,-1.91,;45.74,-4.97,;44.39,-4.19,;43.06,-4.97,;41.72,-4.21,;41.72,-2.67,;40.39,-4.98,;40.39,-6.52,;39.06,-7.29,;41.72,-7.29,;43.05,-6.52,;44.39,-7.3,;44.38,-8.84,;45.71,-9.6,;45.7,-11.15,;44.36,-11.91,;43.04,-11.13,;43.04,-9.6,;44.35,-13.45,;43.01,-14.21,;41.69,-13.43,;45.74,-6.53,;47.07,-7.3,)|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@@H]2CC[C@@H](CC2)OCO)c1=O |r,wD:19.20,22.27,(23.9,-1.62,;22.57,-.85,;21.24,-1.62,;19.89,-.85,;18.57,-1.62,;18.56,-3.15,;19.9,-3.93,;21.23,-3.16,;17.23,-3.91,;15.88,-3.12,;14.54,-3.9,;13.21,-3.14,;13.2,-1.6,;11.88,-3.91,;11.87,-5.45,;10.54,-6.22,;13.21,-6.22,;14.54,-5.46,;15.88,-6.23,;15.87,-7.77,;17.2,-8.54,;17.19,-10.08,;15.85,-10.85,;14.52,-10.07,;14.53,-8.53,;15.84,-12.39,;14.5,-13.15,;13.17,-12.37,;17.22,-5.46,;18.56,-6.24,)|
COc1ccc(cn1)-c1cc2c(C)nc(N)nc2n([C@H]2CC[C@@H](CC2)OCC(O)=O)c1=O |r,wU:22.27,wD:19.20,(12.89,-1.02,;11.56,-.25,;10.23,-1.01,;8.89,-.24,;7.56,-1.01,;7.56,-2.54,;8.89,-3.32,;10.22,-2.55,;6.22,-3.3,;4.87,-2.52,;3.53,-3.3,;2.2,-2.53,;2.19,-.99,;.87,-3.3,;.87,-4.85,;-.48,-5.62,;2.2,-5.62,;3.53,-4.85,;4.87,-5.63,;4.86,-7.16,;3.52,-7.93,;3.51,-9.46,;4.84,-10.24,;6.18,-9.48,;6.19,-7.93,;4.83,-11.78,;3.49,-12.54,;2.16,-11.76,;2.16,-10.22,;.82,-12.52,;6.22,-4.86,;7.55,-5.63,)|
COc1ccc2c(c1)C(=O)N(C2)c3nc(cs3)C(=O)Nc4cnccc4N5CCNCC5
N[C@H]1CC[C@@H](CC1)Nc1ncc(C(N)=O)n2cc(nc12)-c1ccc(Cl)cc1 |r,wU:4.7,wD:1.0,(5.4,-11.59,;6.74,-12.36,;6.74,-13.9,;8.07,-14.67,;9.41,-13.9,;9.4,-12.36,;8.07,-11.59,;10.74,-14.67,;10.75,-16.21,;9.42,-16.98,;9.42,-18.52,;10.75,-19.29,;10.75,-20.83,;9.42,-21.6,;12.09,-21.6,;12.09,-18.51,;13.56,-18.98,;14.46,-17.73,;13.55,-16.49,;12.08,-16.97,;16,-17.72,;16.77,-19.05,;18.31,-19.04,;19.07,-17.7,;20.61,-17.69,;18.29,-16.37,;16.75,-16.38,)|
Clc1ccc(cc1)-c1cc2Cc3cc(ccc3N(Cc3ccccc3-c3cccnc3)C(=O)c2o1)N1CCNCC1
C1CNCC2(C1)CCN(CC2)c1ncnc2nc[nH]c12
C1CCC2(CCN(CC2)c2ncnc3nc[nH]c23)NC1
Oc1ccc(NS(=O)(=O)c2ccc(cc2)[N+]([O-])=O)cc1Sc1nnc[nH]1
CN(C)c1ccc(Oc2cc(O)cc(O)c2-c2cc(no2)C(=O)NC2CCN(CC2)C2CCC3(CC2)OCCO3)cc1
CC(C)Nc1ccc(Oc2cc(O)cc(O)c2-c2cc(no2)C(=O)NC2CCN(C)CC2)cc1
CN(C)c1ccc(Oc2cc(O)cc(O)c2-c2cc(no2)C(=O)NC2CCN(C)CC2)cc1
CN1CCC(CC1)NC(=O)c2cc(on2)c3c(cc(cc3Oc4ccc(cc4)[N+](=O)[O-])O)O
O=C1C=CC(=O)c2ccccc12 |c:2|
C=CC(=O)c1ccccc1
COC(=O)CCC=CC(=O)c1ccccc1 |w:7.7|
COCC=CC(=O)c1ccccc1 |w:4.4|
O[C@@H]1CC(=O)O[C@@H]1C1=CC(=O)c2ccccc2C1=O |r,t:8|
c1cc(c(cc1C2=C(C(=O)c3c(cc(cc3O2)O)O)O)O)O
Cc1c(O)c(O)c2oc(cc2c1C=O)-c1c(C)c(O)c(O)c(O)c1C=O
Cc1c2COC(=O)c2c(O)c(O)c1O
COCc1c(C)c(O)c(O)c(O)c1C=O
COC1OC(=O)c2c1c(C)c(O)c(O)c2O
Cc1c(O)c(O)c2O[C@H]3O[C@H](C(=O)c4c(O)c(O)c(O)c(C)c34)c2c1C=O |r|
COC(=O)c1cc(O)c(O)c(C[C@]2(C)[C@@H](C)CC[C@]3(C)[C@H]2CCC=C3C)c1 |r,c:24|
COc1cc2nc(C)oc2c(C[C@]2(C)[C@@H](C)CC[C@]3(C)[C@H]2CCC=C3C)c1O |r,c:25|
CC(C)CC=Nc1cc(O)c(O)c(C[C@]2(C)[C@@H](C)CC[C@]3(C)[C@H]2CCC=C3C)c1O |r,w:5.5,c:26|
NCCNC(c1ccc(Cl)cc1)c1ccc(cc1)-c1cn[nH]c1
OCCNC(c1ccc(Cl)cc1)c1ccc(cc1)-c1cn[nH]c1
Clc1ccc(cc1)C(NCc1ccccc1)c1ccc(cc1)-c1cn[nH]c1
Clc1ccc(cc1)C(NC1CCCCC1)c1ccc(cc1)-c1cn[nH]c1
Clc1ccc(cc1)C(NC1CC1)c1ccc(cc1)-c1cn[nH]c1
CC(C)(C)NC(c1ccc(Cl)cc1)c1ccc(cc1)-c1cn[nH]c1
CC(C)CNC(c1ccc(Cl)cc1)c1ccc(cc1)-c1cn[nH]c1
CC(C)NC(c1ccc(Cl)cc1)c1ccc(cc1)-c1cn[nH]c1
Clc1ccc(cc1)C(NCc1ccccc1)c1ccc(cc1)-c1ncnc2nc[nH]c12
Clc1ccc(cc1)C(NC1CCCCC1)c1ccc(cc1)-c1ncnc2nc[nH]c12
CC(C)CNC(c1ccc(Cl)cc1)c1ccc(cc1)-c1ncnc2nc[nH]c12
Clc1ccc(cc1)C(NCc1ccccc1)c1ccc(cc1)-c1ccncc1
Clc1ccc(cc1)C(NC1CCCCC1)c1ccc(cc1)-c1ccncc1
CC(C)(C)NC(c1ccc(Cl)cc1)c1ccc(cc1)-c1ccncc1
CC(C)CNC(c1ccc(Cl)cc1)c1ccc(cc1)-c1ccncc1
CC(C)NC(c1ccc(Cl)cc1)c1ccc(cc1)-c1ccncc1
Clc1ccc(cc1)C(NC1CC1)c1ccc(cc1)-c1ncnc2nc[nH]c12
CC(C)NC(c1ccc(Cl)cc1)c1ccc(cc1)-c1ncnc2nc[nH]c12
COc1ccc(cc1OC)S(=O)(=O)Nc1cc(Sc2ncnc3nc[nH]c23)c(O)c2ccccc12
NC(Cc1ccccc1)C(=O)N1CCN(CC1)c1ncnc(N)c1Br
NC(Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc(N)c1Br
NC(Cc1ccc(Cl)cc1)C(=O)N1CCN(CC1)c1ncnc(N)c1Cl
N[C@@H](Cc1ccccc1)C(=O)N1CCN(CC1)c1ncnc(N)c1Cl |r|
NCC1(CCN(CC1)c1cc(N)ncn1)c1ccc(Cl)c(Cl)c1
CNc1cc(ncn1)N1CCC(CN)(CC1)c1ccc(Cl)c(Cl)c1
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(OC2CCOCC2)c2nc(N)nc(C)c2c1
CNc1nc(C)c2cc(cc(OC3CCOCC3)c2n1)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
CNc1nc(C)c2cc(cc(O[C@@H]3CCOC3)c2n1)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1 |r|
COc1ncc(cc1NS(=O)(=O)c1ccc(F)cc1F)-c1cc(O[C@@H]2CCOC2)c2nc(N)nc(C)c2c1 |r|
COc1ccc2nc(NC(=O)CSc3nnc(COc4ccc5CCCCc5c4)o3)sc2c1
[O-][N+](=O)c1cnc(NC(=O)CSc2nnc(COc3ccc4CCCCc4c3)o2)s1
Fc1ccc2nc(NC(=O)CSc3nnc(COc4ccc5CCCCc5c4)o3)sc2c1
CNc1ncc2c(nn(CC3OCCO3)c2n1)-c1ccc(nc1)N1CCNCC1
CNc1ncc2c(nn(CC3CCCC3)c2n1)-c1ccc(nc1)N1CCN(CC1)C(=O)C(C)(C)C
CCN1CCN(CC1)c1ccc(cn1)-c1nn(CC2CCCC2)c2nc(NC)ncc12
CNc1ncc2c(nn(CC3CCCC3)c2n1)-c1ccc(cc1)N1CCN(C)CC1
Nc1nc(Nc2ccc3CC[C@@H](CCc3c2)N2CCCC2)nn1-c1cc2CCCc3ccccc3-c2nn1 |r|
CNc1ncc2c(nn(Cc3cn(Cc4ccccc4)nn3)c2n1)-c1ccc(nc1)N1CCN(CC1)C(=O)C(C)(C)C
CNc1ncc2c(nn(Cc3cn(Cc4ccccc4)nn3)c2n1)-c1ccc(cc1)N1CCNCC1
CNc1ncc2c(nn(Cc3cn(nn3)-c3ccsc3C(=O)OC)c2n1)-c1ccc(nc1)N1CCNCC1
CNc1ncc2c(nn(Cc3cn(Cc4ccccc4)nn3)c2n1)-c1ccc(nc1)N1CCNCC1
CNc1ncc2c(nn(CC3CCCC3)c2n1)-c1ccc(nc1)N1CCNCC1
CNc1ncc2c(nn(CC3CCCC3)c2n1)-c1ccc(nc1)N1CCN(C)CC1
CCN1CCN(CC1)c1ccc(cn1)-c1nn(Cc2cn(Cc3ccccc3)nn2)c2nc(NC)ncc12
CNc1ncc2c(nn(CC3OCCO3)c2n1)-c1ccc(OC)cc1
CNc1ncc2c(nn(Cc3cn(Cc4ccccc4)nn3)c2n1)-c1ccc(nc1)N1CCN(C)CC1
Clc1c[nH]c2ncnc(N3CCN(CC3)C(=O)C3(CCNCC3)c3cccc(Br)c3)c12
Brc1c[nH]c2ncnc(N3CCN(CC3)C(=O)C3(CCNCC3)c3cccc(Br)c3)c12
Clc1ccc(CC(=O)N2CCN(CC2)c2ncnc3[nH]cc(Br)c23)cc1
COc1ccc(cc1)C1(CCNCC1)C(=O)N1CCN(CC1)c1ncnc2[nH]ccc12
Clc1ccc(cc1)C1(CCNCC1)C(=O)N1CCN(CC1)c1ncnc2[nH]ccc12
Clc1c[nH]c2ncnc(N3CCN(CC3)C(=O)C3(CCNCC3)c3ccc(Cl)cc3)c12
Clc1c[nH]c2ncnc(N3CCN(CC3)C(=O)C3(CCNCC3)c3ccc(Br)cc3)c12
Clc1c[nH]c2ncnc(N3CCN(CC3)C(=O)C3(CCNCC3)c3ccc(Cl)c(Cl)c3)c12
Clc1ccc(cc1Cl)C1(CCNCC1)C(=O)N1CCN(CC1)c1ncnc2[nH]cc(Br)c12
Clc1ccc(cc1Cl)C1(CCNCC1)C(=O)N1CCN(CC1)c1ncnc2[nH]ccc12
COc1ccc(cc1)C1(CCNCC1)C(=O)N1CCN(CC1)c1ncnc2[nH]cc(Br)c12
Brc1ccc(cc1)C1(CCNCC1)C(=O)N1CCN(CC1)c1ncnc2[nH]ccc12
Clc1ccc(cc1)C1(CCNCC1)C(=O)N1CCN(CC1)c1ncnc2[nH]cc(Br)c12
CC(C)(C)c1ccc(cc1)C1(CCNCC1)C(=O)N1CCN(CC1)c1ncnc2[nH]ccc12
Brc1c[nH]c2ncnc(N3CCN(CC3)C(=O)C3(CCNCC3)c3ccccc3)c12
Cc1cn2c(cnc2c(Nc2cc(Cc3ccccn3)ns2)n1)-c1cn[nH]c1
Cc1cn2c(cnc2c(Nc2cc(ns2)C(NC(C)(C)C)c2ccccn2)n1)-c1cn[nH]c1
CCN(CCO)Cc1cc(Nc2nc(C)cn3c(cnc23)-c2cn[nH]c2)sn1
O=C(Cc1cccc(OCCCN2CCNCC2)c1)Nc1nc(cs1)-c1ccncc1
O=C(Cc1cccc(OCCCC2CCNCC2)c1)Nc1nc(cs1)-c1ccncc1
CN1CCN(CCCOc2cccc(CC(=O)Nc3nc(cs3)-c3c[nH]c4ncccc34)c2)CC1
CS(=O)(=O)Nc1cccc(CC(=O)Nc2nc(cs2)-c2c[nH]c3ncccc23)c1
O=C(Cc1cccc(OCCCC2CCNCC2)c1)Nc1nc(cs1)-c1c[nH]c2ncccc12
COc1cc(O)c2c(c1)c1c(C)cc(O)cc1oc2=O
COc1cc(O)c2c(c1)c1c(C)cc(O)c(O)c1oc2=O
[H][C@]12[C@@H](O)CC(=O)c3c(O)ccc(-c4ccc(O)c5C(=O)CC[C@]1(O)c45)c23 |r|
COc1cc(O)c2c(c1)-c1cc(O)c(O)cc1COC2=O
Cc1cc(O)c(O)cc1-c1cc(O)cc(O)c1C(O)=O
COc1cc(O)c(C(O)=O)c(c1)-c1cc(O)c(O)cc1C
Cc1cc(O)cc2oc(=O)c3c(O)cc(O)cc3c12
COc1cc(O)c(C(O)=O)c(c1)C1=C(C)C[C@@H](O)C1=O |r,wD:16.17,c:13,(10.48,-22.79,;11.26,-21.46,;10.49,-20.12,;11.26,-18.8,;10.49,-17.47,;11.26,-16.14,;8.97,-17.47,;8.2,-16.14,;8.96,-14.8,;6.65,-16.13,;8.21,-18.79,;8.97,-20.12,;6.66,-18.79,;5.76,-17.54,;4.98,-16.2,;4.29,-18.01,;4.29,-19.55,;3.04,-20.45,;5.75,-20.03,;6.22,-21.5,)|
Cc1cc(O)cc2oc(=O)c3c(O)cc(OS(O)(=O)=O)cc3c12
COc1cc2c(C(=O)OC22C(C)CC(=O)C2=O)c(O)c1
COc1cc(O)c2C(=O)C3=C([C@@H](O)[C@](C)(O)[C@H](O)[C@H]3O)C(=O)c2c1-c1c(O)c2C(=O)c3cc(O)c(C)cc3C(=O)c2cc1OC |r,wU:18.19,11.11,13.13,wD:16.16,t:9,(-6.62,-6.52,;-5.29,-5.75,;-3.96,-6.52,;-3.96,-8.06,;-2.63,-8.83,;-2.63,-10.37,;-1.3,-8.07,;.04,-8.83,;.05,-10.37,;1.38,-8.06,;1.38,-6.5,;2.72,-5.72,;2.71,-4.19,;4.06,-6.5,;4.82,-5.16,;5.38,-7.27,;4.07,-8.06,;5.4,-8.82,;2.72,-8.83,;2.72,-10.37,;.03,-5.73,;.02,-4.19,;-1.3,-6.52,;-2.63,-5.75,;-2.6,-3.5,;-1.27,-2.73,;.06,-3.5,;-1.26,-1.19,;.06,-.41,;1.4,-1.16,;.05,1.13,;1.37,1.91,;1.36,3.45,;2.68,4.23,;.01,4.21,;-.01,5.74,;-1.31,3.42,;-1.29,1.89,;-2.62,1.11,;-3.96,1.87,;-2.6,-.43,;-3.93,-1.19,;-3.93,-2.74,;-5.26,-3.5,;-6.59,-2.73,)|
COc1cc(O)c2C(=O)c3cc(O)c(C)cc3C(=O)c2c1
COc1cc(O)c2C(=O)C3=C([C@@H](O)[C@](C)(O)[C@H](O)[C@H]3O)C(=O)c2c1 |r,t:9|
COc1cc(O)c2C(=O)c3c(O)c(O)c(C)cc3C(=O)c2c1
CN(C)Cc1c(O)ccc2oc(Cc3ccccc3)cc12
Oc1cccc(CNC(=O)Nc2nc(cs2)-c2ccncc2)c1
OC(=O)C1CN(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)C1
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,)|
CC(C)n1c(C)nc2c(F)cc(cc12)-c1nc(Nc2ccc3CN(CCN(C)C)CCc3n2)ncc1F
Cc1cnn(C)c1-c1ccc(s1)C(=O)N[C@@H]1CNCC[C@H]1c1cccc(F)c1
Cn1ncc(Cl)c1-c1csc(c1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1 |r|
Cn1nccc1-c1ccc(s1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1
Cn1nccc1-c1ccc(s1)C(=O)N[C@@H]1CNCC[C@H]1c1cccc(F)c1
Cn1ncc(Cl)c1-c1ccc(s1)C(=O)N[C@@H]1CNCC[C@H]1c1cccc(F)c1
Cn1ncc(C=C)c1-c1ccc(s1)C(=O)N[C@@H]1CNCC[C@H]1c1cccc(F)c1
CCc1cnn(C)c1-c1ccc(s1)C(=O)N[C@@H]1CNCC[C@H]1c1cccc(F)c1
Cn1ncc(CO)c1-c1ccc(s1)C(=O)N[C@@H]1CNCC[C@H]1c1cccc(F)c1
Cn1ncc(c1-c1ccc(s1)C(=O)N[C@@H]1CNCC[C@H]1c1cccc(F)c1)-c1ccccc1
Cn1ncc(Cl)c1-c1csc(c1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)c(c1)C(F)(F)F
Cn1ncc(Cl)c1-c1cc(sc1Cl)C(=O)N[C@@H]1CNCC[C@H]1c1cccc(F)c1 |r,wU:16.17,wD:21.24,(51.22,-23.48,;50.75,-24.94,;49.28,-25.42,;49.28,-26.96,;50.74,-27.44,;51.22,-28.9,;51.66,-26.19,;53.2,-26.19,;54.23,-27.33,;55.64,-26.7,;55.47,-25.17,;53.97,-24.85,;53.34,-23.45,;56.98,-27.46,;56.98,-29,;58.31,-26.69,;59.65,-27.46,;59.65,-29,;60.98,-29.76,;62.31,-29,;62.31,-27.46,;60.98,-26.68,;60.98,-25.14,;59.65,-24.37,;59.64,-22.84,;60.98,-22.06,;62.31,-22.83,;63.65,-22.06,;62.31,-24.37,)|
Cn1ncc(c1-c1ccc(s1)C(=O)N[C@@H]1CNCC[C@H]1c1cccc(F)c1)-c1ccncc1
Cn1ncc(Cl)c1-c1csc(c1)C(=O)N[C@@H]1CNCC[C@H]1c1cccc(F)c1
Cn1ncc(Cl)c1-c1ccc(s1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1
Cn1ncc(Br)c1-c1ccc(s1)C(=O)N[C@@H]1CNCC[C@H]1c1cccc(F)c1
Cn1ncc(C(O)=O)c1-c1ccc(s1)C(=O)N[C@@H]1CNCC[C@H]1c1cccc(F)c1
Cn1ncc(Cl)c1-c1ccc(s1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)c(c1)C(F)(F)F
Cc1c(Cc2ccc(NC(=O)Nc3ccc(Br)cc3)nc2)c(=O)oc2cc(O)c(cc12)C(C)(C)C
COc1ccc(NC(=O)Nc2ccc(Cc3c(C)c4cc(c(O)cc4oc3=O)C(C)(C)C)cn2)cc1
Cc1ccc(NC(=O)Nc2ccc(Cc3c(C)c4cc(c(O)cc4oc3=O)C(C)(C)C)cn2)cc1
Cc1c(Cc2ccc(NC(=O)Nc3cccc(Cl)c3)nc2)c(=O)oc2cc(O)c(cc12)C(C)(C)C
Cc1c(Cc2ccc(NC(=O)Nc3ccc(F)c(F)c3)nc2)c(=O)oc2cc(O)c(cc12)C(C)(C)C
Cc1c(Cc2ccc(NC(=O)Nc3ccccc3Cl)nc2)c(=O)oc2cc(O)c(cc12)C(C)(C)C
Cc1c(Cc2ccc(NC(=O)Nc3ccc(F)cc3)nc2)c(=O)oc2cc(O)c(cc12)C(C)(C)C
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CC(=O)NC2CC2)C[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,19.21,wD:28.32,(60.53,-24.37,;60.21,-25.88,;58.8,-26.5,;58.96,-28.03,;60.46,-28.36,;61.09,-29.77,;61.24,-27.03,;62.77,-26.87,;63.8,-28.01,;65.22,-27.39,;65.05,-25.86,;63.55,-25.54,;62.92,-24.13,;66.55,-28.17,;66.54,-29.7,;67.88,-27.4,;69.22,-28.17,;69.21,-29.71,;70.54,-30.48,;71.88,-29.72,;73.21,-30.49,;74.55,-29.73,;74.55,-28.19,;75.88,-30.5,;77.21,-29.74,;78.75,-29.74,;77.98,-28.4,;71.89,-28.17,;70.55,-27.4,;70.55,-25.87,;69.22,-25.1,;69.22,-23.56,;70.55,-22.79,;70.54,-21.25,;71.88,-23.55,;73.21,-22.78,;71.89,-25.1,)|
Cn1ncc(Cl)c1-c1cc(sc1Cl)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(F)c(F)c1 |r,wU:16.17,wD:21.24,(6.93,-41.03,;6.61,-42.53,;5.2,-43.15,;5.36,-44.69,;6.87,-45.01,;7.49,-46.42,;7.64,-43.68,;9.17,-43.52,;10.2,-44.67,;11.61,-44.04,;11.45,-42.52,;9.95,-42.19,;9.33,-40.78,;12.94,-44.81,;12.94,-46.35,;14.28,-44.05,;15.61,-44.82,;15.61,-46.35,;16.94,-47.13,;18.27,-46.36,;18.28,-44.82,;16.95,-44.05,;16.95,-42.52,;15.62,-41.75,;15.62,-40.2,;16.95,-39.43,;16.95,-37.89,;18.29,-40.2,;19.62,-39.42,;18.29,-41.75,)|
Cn1ncc(Cl)c1-c1coc(c1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(F)c(F)c1 |r|
COCC[C@@H]1C[C@H]([C@@H](CN1)NC(=O)c1cc(c(Cl)o1)-c1c(Cl)cnn1C)c1ccc(Cl)c(Cl)c1 |r,wU:7.10,4.3,wD:6.28,(49.19,-26.41,;47.85,-27.18,;46.52,-26.4,;45.19,-27.17,;43.85,-26.39,;43.86,-24.85,;42.53,-24.08,;41.19,-24.85,;41.19,-26.38,;42.52,-27.16,;39.86,-24.08,;38.52,-24.84,;38.52,-26.38,;37.19,-24.07,;35.78,-24.69,;34.75,-23.55,;35.52,-22.21,;34.9,-20.81,;37.03,-22.54,;33.21,-23.71,;32.44,-25.04,;33.06,-26.45,;30.94,-24.71,;30.78,-23.18,;32.19,-22.56,;32.51,-21.05,;42.53,-22.55,;41.19,-21.78,;41.2,-20.24,;42.52,-19.47,;42.52,-17.93,;43.86,-20.23,;45.19,-19.46,;43.87,-21.78,)|
Cn1nccc1-c1ccc(cn1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(F)c(F)c1 |r|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,wD:21.24,(6.56,-7.47,;6.24,-8.98,;4.83,-9.6,;4.99,-11.13,;6.49,-11.45,;7.12,-12.86,;7.27,-10.12,;8.8,-9.97,;9.83,-11.12,;11.23,-10.49,;11.08,-8.96,;9.57,-8.64,;8.95,-7.23,;12.56,-11.27,;12.56,-12.81,;13.9,-10.5,;15.23,-11.27,;15.23,-12.81,;16.56,-13.59,;17.89,-12.82,;17.9,-11.27,;16.57,-10.51,;16.57,-8.97,;15.24,-8.2,;15.24,-6.66,;16.57,-5.89,;16.57,-4.35,;17.91,-6.65,;19.24,-5.88,;17.91,-8.2,)|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)NC1CNCCC1c1ccc(cc1)C(F)(F)F
CC(=O)OCC[C@@H]1C[C@H]([C@@H](CN1)NC(=O)c1cc(c(Cl)o1)-c1c(Cl)cnn1C)c1ccc(F)c(F)c1 |r,wU:9.12,6.5,wD:8.30,(80.83,-29.2,;79.5,-28.42,;79.51,-26.88,;78.16,-29.19,;76.83,-28.41,;75.5,-29.18,;74.16,-28.4,;74.17,-26.86,;72.84,-26.09,;71.5,-26.86,;71.5,-28.39,;72.83,-29.17,;70.17,-26.08,;68.83,-26.85,;68.83,-28.39,;67.5,-26.08,;66.09,-26.7,;65.06,-25.55,;65.83,-24.22,;65.21,-22.81,;67.34,-24.55,;63.52,-25.71,;62.75,-27.04,;63.37,-28.45,;61.25,-26.72,;61.09,-25.19,;62.5,-24.57,;62.82,-23.06,;72.84,-24.56,;71.5,-23.79,;71.51,-22.24,;72.83,-21.47,;72.83,-19.93,;74.17,-22.24,;75.5,-21.46,;74.18,-23.79,)|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CC(=O)NCCO)C[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,19.21,wD:28.31,(36.28,-40.31,;35.95,-41.82,;34.54,-42.44,;34.7,-43.97,;36.21,-44.29,;36.83,-45.7,;36.98,-42.96,;38.51,-42.8,;39.54,-43.95,;40.96,-43.33,;40.79,-41.8,;39.29,-41.47,;38.67,-40.06,;42.29,-44.1,;42.28,-45.64,;43.62,-43.34,;44.96,-44.11,;44.95,-45.64,;46.28,-46.42,;47.62,-45.65,;48.95,-46.43,;50.29,-45.66,;50.29,-44.12,;51.62,-46.44,;52.95,-45.67,;54.28,-46.45,;55.62,-45.68,;47.63,-44.11,;46.29,-43.34,;46.29,-41.81,;44.96,-41.04,;44.96,-39.5,;46.29,-38.72,;46.28,-37.18,;47.62,-39.49,;48.96,-38.71,;47.63,-41.04,)|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CCCO)C[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,19.21,wD:25.28,(51.63,-7.29,;51.3,-8.79,;49.9,-9.41,;50.05,-10.95,;51.56,-11.27,;52.18,-12.68,;52.33,-9.94,;53.87,-9.78,;54.89,-10.93,;56.31,-10.3,;56.15,-8.77,;54.64,-8.45,;54.02,-7.04,;57.64,-11.08,;57.64,-12.62,;58.98,-10.31,;60.31,-11.08,;60.3,-12.62,;61.63,-13.39,;62.97,-12.63,;64.3,-13.4,;65.64,-12.64,;66.97,-13.41,;68.31,-12.65,;62.98,-11.08,;61.65,-10.32,;61.64,-8.79,;60.31,-8.02,;60.31,-6.47,;61.64,-5.7,;61.64,-4.16,;62.98,-6.46,;64.31,-5.69,;62.98,-8.01,)|
Cn1ncc(Cl)c1-c1ccc(cn1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(F)c(F)c1 |r|
Cn1ncc(Cl)c1-c1cc(C(=O)N[C@@H]2CNCC[C@H]2c2ccc(Cl)cc2)n(C)c1Cl |r,wU:13.13,wD:18.20,(7.44,-7.12,;7.12,-8.63,;5.71,-9.25,;5.87,-10.78,;7.37,-11.11,;7.99,-12.52,;8.15,-9.78,;9.68,-9.62,;10.71,-10.77,;12.12,-10.14,;13.45,-10.91,;13.44,-12.45,;14.78,-10.14,;16.12,-10.92,;16.11,-12.45,;17.44,-13.23,;18.78,-12.46,;18.79,-10.92,;17.45,-10.15,;17.46,-8.61,;16.12,-7.84,;16.13,-6.3,;17.46,-5.53,;17.45,-3.99,;18.79,-6.29,;18.8,-7.84,;11.96,-8.61,;13.1,-7.58,;10.45,-8.29,;9.83,-6.88,)|
Cn1ncc(Br)c1-c1coc(c1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1 |r|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(cc1)C(F)(F)F
CC(=O)NCC[C@@H]1C[C@H]([C@@H](CN1)NC(=O)c1cc(c(Cl)o1)-c1c(Cl)cnn1C)c1ccc(F)c(F)c1 |r,wU:9.12,6.5,wD:8.30,(53.86,-29.77,;52.53,-29,;52.54,-27.46,;51.2,-29.76,;49.87,-28.99,;48.53,-29.75,;47.2,-28.98,;47.21,-27.43,;45.87,-26.67,;44.54,-27.43,;44.53,-28.97,;45.86,-29.74,;43.2,-26.66,;41.87,-27.43,;41.86,-28.97,;40.54,-26.65,;39.12,-27.27,;38.09,-26.13,;38.87,-24.8,;38.25,-23.39,;40.37,-25.12,;36.56,-26.29,;35.79,-27.62,;36.41,-29.03,;34.28,-27.3,;34.12,-25.76,;35.53,-25.14,;35.86,-23.64,;45.87,-25.13,;44.54,-24.36,;44.54,-22.82,;45.87,-22.05,;45.86,-20.51,;47.2,-22.81,;48.54,-22.04,;47.21,-24.36,)|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CCNS(C)(=O)=O)C[C@H]1c1ccc(F)c(F)c1 |r,wU:16.17,19.21,wD:28.31,(6.19,-22.87,;5.87,-24.37,;4.46,-24.99,;4.62,-26.53,;6.12,-26.85,;6.74,-28.26,;6.89,-25.52,;8.43,-25.36,;9.46,-26.5,;10.87,-25.88,;10.71,-24.35,;9.2,-24.03,;8.58,-22.62,;12.2,-26.66,;12.2,-28.2,;13.54,-25.89,;14.87,-26.66,;14.87,-28.2,;16.2,-28.97,;17.53,-28.21,;18.87,-28.98,;20.2,-28.22,;21.53,-28.99,;22.87,-28.23,;24.2,-29,;22.09,-26.89,;23.64,-26.88,;17.54,-26.66,;16.21,-25.9,;16.21,-24.36,;14.87,-23.59,;14.88,-22.05,;16.2,-21.28,;16.2,-19.74,;17.54,-22.04,;18.87,-21.27,;17.55,-23.59,)|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CC(O)CO)C[C@H]1c1ccc(F)c(F)c1 |r,wU:16.17,19.21,wD:26.29,(33.44,-6.73,;33.11,-8.23,;31.7,-8.85,;31.86,-10.39,;33.37,-10.71,;33.99,-12.12,;34.14,-9.38,;35.68,-9.22,;36.7,-10.37,;38.12,-9.74,;37.95,-8.21,;36.45,-7.89,;35.83,-6.48,;39.45,-10.52,;39.45,-12.06,;40.79,-9.75,;42.12,-10.52,;42.11,-12.06,;43.44,-12.83,;44.78,-12.07,;46.11,-12.84,;47.45,-12.08,;47.45,-10.54,;48.78,-12.85,;50.11,-12.09,;44.79,-10.52,;43.45,-9.76,;43.45,-8.23,;42.12,-7.46,;42.12,-5.91,;43.45,-5.14,;43.45,-3.6,;44.79,-5.9,;46.12,-5.13,;44.79,-7.45,)|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CCO)C[C@H]1c1ccc(F)c(F)c1 |r,wU:16.17,19.21,wD:24.27,(5.73,-5.85,;5.41,-7.35,;4,-7.98,;4.16,-9.51,;5.66,-9.83,;6.29,-11.24,;6.44,-8.5,;7.97,-8.34,;9,-9.49,;10.41,-8.86,;10.25,-7.33,;8.75,-7.01,;8.12,-5.6,;11.75,-9.64,;11.74,-11.18,;13.08,-8.87,;14.41,-9.65,;14.41,-11.18,;15.74,-11.96,;17.08,-11.19,;18.41,-11.96,;19.74,-11.2,;21.07,-11.97,;17.08,-9.64,;15.75,-8.88,;15.75,-7.35,;14.42,-6.58,;14.42,-5.03,;15.75,-4.26,;15.74,-2.72,;17.08,-5.03,;18.41,-4.25,;17.09,-6.58,)|
CNC(=O)C[C@@H]1C[C@H]([C@@H](CN1)NC(=O)c1cc(c(Cl)o1)-c1c(Cl)cnn1C)c1ccc(Cl)c(Cl)c1 |r,wU:8.11,5.4,wD:7.29,(50.5,-29.31,;49.16,-30.08,;47.83,-29.31,;47.83,-27.77,;46.49,-30.07,;45.16,-29.3,;45.17,-27.75,;43.84,-26.98,;42.5,-27.75,;42.49,-29.29,;43.82,-30.06,;41.17,-26.98,;39.83,-27.74,;39.83,-29.28,;38.5,-26.97,;37.08,-27.59,;36.06,-26.45,;36.83,-25.12,;36.21,-23.71,;38.34,-25.44,;34.52,-26.61,;33.75,-27.94,;34.37,-29.35,;32.24,-27.61,;32.09,-26.08,;33.49,-25.46,;33.82,-23.95,;43.83,-25.45,;42.5,-24.68,;42.5,-23.14,;43.83,-22.37,;43.83,-20.83,;45.17,-23.13,;46.5,-22.36,;45.17,-24.68,)|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CC(N)=O)C[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,19.21,wD:25.28,(8.94,-24.9,;8.62,-26.4,;7.21,-27.02,;7.37,-28.56,;8.87,-28.88,;9.5,-30.29,;9.65,-27.55,;11.18,-27.39,;12.21,-28.53,;13.63,-27.91,;13.46,-26.38,;11.96,-26.06,;11.33,-24.65,;14.96,-28.69,;14.95,-30.23,;16.29,-27.92,;17.62,-28.69,;17.62,-30.23,;18.95,-31,;20.29,-30.24,;21.62,-31.01,;22.96,-30.25,;24.29,-31.02,;22.96,-28.71,;20.3,-28.69,;18.96,-27.93,;18.96,-26.39,;17.63,-25.62,;17.63,-24.08,;18.96,-23.31,;18.95,-21.77,;20.29,-24.07,;21.62,-23.3,;20.3,-25.62,)|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CC(O)=O)C[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,19.21,wD:25.28,(63.36,-7.24,;63.04,-8.75,;61.63,-9.37,;61.79,-10.9,;63.29,-11.22,;63.92,-12.63,;64.07,-9.89,;65.6,-9.73,;66.63,-10.88,;68.05,-10.26,;67.88,-8.72,;66.38,-8.4,;65.75,-6.99,;69.38,-11.03,;69.37,-12.57,;70.71,-10.26,;72.04,-11.04,;72.04,-12.57,;73.37,-13.35,;74.71,-12.58,;76.04,-13.36,;77.37,-12.59,;78.71,-13.37,;77.38,-11.05,;74.71,-11.04,;73.38,-10.27,;73.38,-8.74,;72.05,-7.97,;72.05,-6.42,;73.38,-5.65,;73.37,-4.11,;74.71,-6.42,;76.04,-5.64,;74.72,-7.97,)|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CCN2CCC(O)CC2)C[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,19.21,wD:30.34,(8.31,-7.58,;7.99,-9.09,;6.58,-9.71,;6.74,-11.24,;8.24,-11.57,;8.87,-12.97,;9.02,-10.23,;10.55,-10.07,;11.58,-11.22,;13,-10.6,;12.83,-9.07,;11.33,-8.74,;10.7,-7.33,;14.33,-11.37,;14.32,-12.91,;15.66,-10.61,;16.99,-11.38,;16.99,-12.91,;18.32,-13.69,;19.66,-12.92,;20.99,-13.7,;22.32,-12.93,;23.66,-13.71,;23.64,-15.25,;24.96,-16.02,;26.31,-15.26,;27.63,-16.04,;26.31,-13.72,;24.98,-12.94,;19.66,-11.38,;18.33,-10.61,;18.33,-9.08,;17,-8.31,;17,-6.77,;18.33,-6,;18.32,-4.46,;19.66,-6.76,;20.99,-5.98,;19.67,-8.31,)|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CCN2CCCCC2)C[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,19.21,wD:29.33,(32.6,-37.45,;32.28,-38.96,;30.87,-39.58,;31.03,-41.12,;32.53,-41.44,;33.16,-42.85,;33.31,-40.11,;34.84,-39.95,;35.87,-41.09,;37.28,-40.47,;37.12,-38.94,;35.62,-38.62,;34.99,-37.21,;38.62,-41.25,;38.61,-42.79,;39.95,-40.48,;41.28,-41.25,;41.28,-42.79,;42.61,-43.56,;43.95,-42.8,;45.28,-43.57,;46.61,-42.81,;47.94,-43.58,;47.93,-45.12,;49.25,-45.89,;50.59,-45.13,;50.6,-43.59,;49.27,-42.81,;43.95,-41.25,;42.62,-40.49,;42.62,-38.95,;41.29,-38.18,;41.29,-36.64,;42.62,-35.87,;42.61,-34.33,;43.95,-36.63,;45.28,-35.86,;43.96,-38.18,)|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CCN2CCCC2)C[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,19.21,wD:28.32,(7.84,-37.33,;7.52,-38.84,;6.11,-39.46,;6.26,-40.99,;7.77,-41.32,;8.39,-42.72,;8.54,-39.98,;10.08,-39.82,;11.11,-40.97,;12.52,-40.35,;12.36,-38.82,;10.85,-38.49,;10.23,-37.08,;13.85,-41.12,;13.85,-42.66,;15.19,-40.36,;16.52,-41.13,;16.52,-42.66,;17.85,-43.44,;19.18,-42.67,;20.51,-43.45,;21.85,-42.68,;23.18,-43.46,;23.34,-44.98,;24.85,-45.31,;25.62,-43.98,;24.59,-42.83,;19.19,-41.13,;17.86,-40.36,;17.86,-38.83,;16.52,-38.06,;16.52,-36.52,;17.85,-35.75,;17.85,-34.21,;19.19,-36.51,;20.52,-35.73,;19.19,-38.06,)|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CC(O)CO)C[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,19.21,wD:26.29,(6.28,-22.36,;5.95,-23.87,;4.54,-24.49,;4.7,-26.02,;6.21,-26.34,;6.83,-27.75,;6.98,-25.01,;8.52,-24.85,;9.54,-26,;10.96,-25.38,;10.79,-23.85,;9.29,-23.52,;8.67,-22.11,;12.29,-26.15,;12.29,-27.69,;13.63,-25.38,;14.96,-26.16,;14.95,-27.69,;16.28,-28.47,;17.62,-27.7,;18.95,-28.48,;20.29,-27.71,;20.29,-26.17,;21.62,-28.49,;22.96,-27.72,;17.63,-26.16,;16.29,-25.39,;16.29,-23.86,;14.96,-23.09,;14.96,-21.54,;16.29,-20.77,;16.29,-19.23,;17.63,-21.54,;18.96,-20.76,;17.63,-23.09,)|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CC=C)C[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,19.21,wD:24.27,(28.2,-6.77,;27.88,-8.27,;26.47,-8.89,;26.63,-10.43,;28.13,-10.75,;28.75,-12.16,;28.91,-9.42,;30.44,-9.26,;31.47,-10.41,;32.88,-9.78,;32.72,-8.25,;31.21,-7.93,;30.59,-6.52,;34.22,-10.56,;34.21,-12.1,;35.55,-9.79,;36.88,-10.56,;36.88,-12.1,;38.21,-12.87,;39.55,-12.11,;40.88,-12.88,;42.21,-12.12,;43.54,-12.89,;39.55,-10.56,;38.22,-9.8,;38.22,-8.26,;36.88,-7.49,;36.89,-5.95,;38.22,-5.18,;38.21,-3.64,;39.55,-5.94,;40.88,-5.17,;39.56,-7.49,)|
Cn1ncc(Br)c1-c1ccc(nc1)C(=O)N[C@@H]1CNCC[C@H]1c1cccc(F)c1 |r|
Cn1ncc(Cl)c1-c1ccc(nc1)C(=O)N[C@@H]1CNCC[C@H]1c1cccc(F)c1 |r|
Cn1nccc1-c1ccc(nc1)C(=O)N[C@@H]1CNCC[C@H]1c1cccc(F)c1 |r|
Cn1ncc(Cl)c1-c1ccc(cc1)C(=O)N[C@@H]1CNCC[C@H]1c1cccc(F)c1 |r|
Cn1ncc(Br)c1-c1ccc(cc1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(F)c(F)c1 |r|
Cn1nccc1-c1ccc(cc1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(F)c(F)c1 |r|
Cn1cc(cc1C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1)-c1c(Br)cnn1C |r|
Cn1cc(cc1C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1)-c1c(Cl)cnn1C |r|
Cn1ncc(Cl)c1-c1cc(sc1Cl)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1 |r,wU:16.17,wD:21.24,(51.27,-23.63,;50.95,-25.13,;49.54,-25.76,;49.7,-27.29,;51.21,-27.61,;51.83,-29.02,;51.98,-26.28,;53.51,-26.12,;54.54,-27.27,;55.95,-26.64,;55.79,-25.12,;54.29,-24.79,;53.66,-23.38,;57.28,-27.41,;57.28,-28.95,;58.62,-26.65,;59.95,-27.42,;59.95,-28.95,;61.28,-29.73,;62.61,-28.96,;62.62,-27.42,;61.29,-26.65,;61.29,-25.12,;59.96,-24.35,;59.96,-22.8,;61.29,-22.03,;61.29,-20.49,;62.63,-22.8,;62.63,-24.35,)|
Cn1ncc(Br)c1-c1oc(cc1Br)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1 |r,wU:16.17,wD:21.24,(7.1,-22.52,;6.77,-24.03,;5.37,-24.65,;5.52,-26.18,;7.03,-26.51,;7.65,-27.92,;7.81,-25.18,;9.34,-25.02,;10.37,-26.17,;11.77,-25.54,;11.62,-24.01,;10.11,-23.69,;9.49,-22.28,;13.11,-26.31,;13.1,-27.85,;14.44,-25.54,;15.77,-26.32,;15.77,-27.85,;17.1,-28.63,;18.44,-27.86,;18.44,-26.32,;17.11,-25.55,;17.12,-24.01,;15.78,-23.24,;15.79,-21.7,;17.11,-20.93,;17.11,-19.39,;18.45,-21.69,;18.46,-23.24,)|
Cn1nccc1-c1oc(cc1Br)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1 |r|
Cn1ncc(Br)c1-c1ccc(o1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1 |r|
Cn1nccc1-c1coc(c1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1 |r|
OC1CCc2c1ncnc2-c1ccc(s1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1 |r|
CNc1cc(ncn1)-c1ccc(o1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1 |r|
Clc1ccc(cc1)[C@@H]1CCNC[C@H]1NC(=O)c1ccc(o1)-c1cn[nH]c1 |r|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1 |r,wU:16.17,wD:21.24,(47.52,-7.99,;47.2,-9.5,;45.79,-10.12,;45.95,-11.65,;47.45,-11.98,;48.07,-13.38,;48.22,-10.64,;49.76,-10.49,;50.79,-11.64,;52.19,-11.02,;52.04,-9.48,;50.53,-9.16,;49.91,-7.75,;53.52,-11.79,;53.52,-13.33,;54.86,-11.02,;56.19,-11.8,;56.18,-13.33,;57.51,-14.11,;58.85,-13.34,;58.86,-11.79,;57.52,-11.03,;57.53,-9.49,;56.2,-8.72,;56.2,-7.18,;57.53,-6.41,;57.52,-4.87,;58.86,-7.17,;58.87,-8.72,)|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@H]1CNCC[C@@H]1c1ccc(F)c(F)c1
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@H]1CNCC[C@@H]1c1ccc(cc1)C(F)(F)F
Cn1ncc(Br)c1-c1coc(c1)C(=O)NC1CNCC1c1ccc(F)c(F)c1
Cn1ncc(Cl)c1-c1coc(c1)C(=O)NC1CNCC1c1ccc(F)c(F)c1
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)NC1CNCCC1c1ccc(F)c(F)c1
Cn1nccc1-c1coc(c1)C(=O)NC1CNCCC1c1ccc(F)c(F)c1
Cn1nccc1-c1coc(c1)C(=O)NC1CNCCC1c1ccccc1
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(F)c(F)c1
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CCO)C[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,19.21,wD:24.27,(72.74,-6.97,;72.42,-8.47,;71.01,-9.1,;71.17,-10.63,;72.67,-10.95,;73.3,-12.36,;73.45,-9.62,;74.98,-9.46,;76.01,-10.61,;77.43,-9.98,;77.26,-8.45,;75.76,-8.13,;75.13,-6.72,;78.76,-10.76,;78.75,-12.3,;80.09,-9.99,;81.42,-10.77,;81.42,-12.3,;82.75,-13.08,;84.09,-12.31,;85.42,-13.08,;86.76,-12.32,;88.09,-13.09,;84.1,-10.76,;82.76,-10,;82.76,-8.47,;81.43,-7.7,;81.43,-6.15,;82.76,-5.38,;82.75,-3.84,;84.09,-6.15,;85.42,-5.37,;84.1,-7.7,)|
Cn1ncc(Br)c1-c1cc(C(=O)N[C@@H]2CNCC[C@H]2c2ccc(Cl)cc2)n(C)c1Br |r,wU:13.13,wD:18.20,(29.24,-7.31,;28.92,-8.82,;27.51,-9.44,;27.67,-10.97,;29.17,-11.29,;29.79,-12.7,;29.95,-9.96,;31.48,-9.81,;32.51,-10.95,;33.92,-10.32,;35.25,-11.1,;35.25,-12.64,;36.59,-10.33,;37.92,-11.1,;37.91,-12.64,;39.24,-13.41,;40.58,-12.65,;40.59,-11.1,;39.25,-10.34,;39.26,-8.8,;37.93,-8.03,;37.93,-6.49,;39.26,-5.72,;39.25,-4.18,;40.59,-6.48,;40.6,-8.03,;33.76,-8.8,;34.91,-7.77,;32.25,-8.48,;31.63,-7.07,)|
Cn1nccc1-c1ccc(o1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1 |r|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CNCC[C@@H]1c1ccc(F)c(F)c1 |r,wU:16.17,21.24,(13.12,-9.28,;12.8,-10.78,;11.39,-11.41,;11.55,-12.94,;13.05,-13.27,;13.67,-14.67,;13.82,-11.93,;15.36,-11.78,;16.38,-12.93,;17.79,-12.3,;17.64,-10.77,;16.13,-10.44,;15.51,-9.04,;19.12,-13.08,;19.11,-14.62,;20.45,-12.31,;21.78,-13.09,;21.78,-14.62,;23.11,-15.39,;24.44,-14.63,;24.45,-13.08,;23.12,-12.31,;23.13,-10.78,;21.79,-10.01,;21.79,-8.47,;23.12,-7.7,;23.12,-6.16,;24.46,-8.46,;25.78,-7.68,;24.46,-10.01,)|
Cn1cc(cn1)-c1ccc(o1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1 |r|
CNC(=O)C[C@@H]1C[C@H]([C@@H](CN1)NC(=O)c1cc(c(Cl)o1)-c1c(Cl)cnn1C)c1ccc(F)c(F)c1 |r,wU:8.11,5.4,wD:7.29,(76.34,-11.8,;75,-12.56,;73.67,-11.79,;73.68,-10.25,;72.34,-12.55,;71.01,-11.78,;71.01,-10.23,;69.68,-9.47,;68.34,-10.24,;68.34,-11.77,;69.67,-12.55,;67.01,-9.46,;65.68,-10.23,;65.67,-11.77,;64.34,-9.46,;62.93,-10.08,;61.9,-8.93,;62.68,-7.6,;62.05,-6.19,;64.18,-7.92,;60.37,-9.09,;59.59,-10.42,;60.22,-11.83,;58.09,-10.1,;57.93,-8.57,;59.34,-7.94,;59.66,-6.44,;69.68,-7.94,;68.35,-7.17,;68.35,-5.62,;69.68,-4.85,;69.67,-3.31,;71.01,-5.62,;72.34,-4.84,;71.02,-7.17,)|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CC(=O)NC2CCC2)C[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,19.21,wD:29.33,(8.88,-41.02,;8.56,-42.52,;7.15,-43.15,;7.31,-44.68,;8.81,-45,;9.44,-46.41,;9.59,-43.67,;11.12,-43.51,;12.15,-44.66,;13.56,-44.04,;13.4,-42.5,;11.89,-42.18,;11.27,-40.77,;14.9,-44.81,;14.89,-46.35,;16.23,-44.04,;17.56,-44.82,;17.56,-46.35,;18.89,-47.13,;20.23,-46.36,;21.56,-47.13,;22.89,-46.37,;22.9,-44.83,;24.22,-47.14,;25.56,-46.38,;27.05,-46.79,;27.45,-45.3,;25.96,-44.9,;20.23,-44.81,;18.9,-44.05,;18.9,-42.52,;17.57,-41.75,;17.57,-40.2,;18.9,-39.43,;18.89,-37.89,;20.23,-40.2,;21.56,-39.42,;20.24,-41.75,)|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CCn2cncn2)C[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,19.21,wD:28.32,(35.98,-7.3,;35.66,-8.81,;34.25,-9.43,;34.4,-10.96,;35.91,-11.29,;36.53,-12.69,;36.68,-9.95,;38.22,-9.79,;39.25,-10.94,;40.66,-10.32,;40.5,-8.79,;38.99,-8.46,;38.37,-7.05,;41.99,-11.09,;41.99,-12.63,;43.33,-10.33,;44.66,-11.1,;44.66,-12.63,;45.99,-13.41,;47.32,-12.64,;48.65,-13.42,;49.99,-12.65,;51.32,-13.43,;51.48,-14.95,;52.99,-15.28,;53.76,-13.95,;52.73,-12.8,;47.33,-11.1,;46,-10.33,;46,-8.8,;44.66,-8.03,;44.66,-6.49,;45.99,-5.72,;45.99,-4.18,;47.33,-6.48,;48.66,-5.7,;47.33,-8.03,)|
CN(C)CC[C@@H]1C[C@H]([C@@H](CN1)NC(=O)c1cc(c(Cl)o1)-c1c(Cl)cnn1C)c1ccc(Cl)c(Cl)c1 |r,wU:8.11,5.4,wD:7.29,(76.96,-26.16,;75.63,-26.92,;75.62,-28.46,;74.3,-26.15,;72.96,-26.91,;71.63,-26.14,;71.64,-24.59,;70.3,-23.83,;68.97,-24.59,;68.96,-26.13,;70.29,-26.9,;67.63,-23.82,;66.3,-24.59,;66.29,-26.13,;64.97,-23.81,;63.55,-24.44,;62.52,-23.29,;63.3,-21.96,;62.67,-20.55,;64.8,-22.28,;60.99,-23.45,;60.21,-24.78,;60.84,-26.19,;58.71,-24.46,;58.55,-22.92,;59.96,-22.3,;60.28,-20.8,;70.3,-22.3,;68.97,-21.53,;68.97,-19.98,;70.3,-19.21,;70.29,-17.67,;71.63,-19.97,;72.96,-19.2,;71.64,-21.52,)|
CCC[C@@H]1C[C@H]([C@@H](CN1)NC(=O)c1cc(c(Cl)o1)-c1c(Cl)cnn1C)c1ccc(Cl)c(Cl)c1 |r,wU:6.9,3.2,wD:5.27,(21.58,-13.12,;20.25,-12.34,;18.91,-13.11,;17.58,-12.33,;17.59,-10.79,;16.26,-10.02,;14.92,-10.79,;14.91,-12.32,;16.24,-13.1,;13.59,-10.02,;12.25,-10.78,;12.25,-12.32,;10.92,-10.01,;9.5,-10.63,;8.48,-9.48,;9.25,-8.15,;8.63,-6.74,;10.76,-8.48,;6.94,-9.64,;6.17,-10.97,;6.79,-12.38,;4.66,-10.65,;4.51,-9.12,;5.91,-8.5,;6.24,-6.99,;16.25,-8.49,;14.92,-7.72,;14.92,-6.18,;16.25,-5.4,;16.25,-3.86,;17.59,-6.17,;18.92,-5.39,;17.59,-7.72,)|
Cn1ncc(Br)c1-c1ccc(cn1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(F)c(F)c1 |r|
Cn1ncc(Cl)c1-c1ccc(cc1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(F)c(F)c1 |r|
Cn1ncc(Cl)c1-c1cc(sc1Cl)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)c(c1)C(F)(F)F |r,wU:16.17,wD:21.24,(29.14,-40.46,;28.82,-41.96,;27.41,-42.59,;27.56,-44.12,;29.07,-44.44,;29.69,-45.85,;29.85,-43.11,;31.38,-42.96,;32.41,-44.1,;33.82,-43.47,;33.66,-41.95,;32.15,-41.62,;31.53,-40.22,;35.15,-44.24,;35.14,-45.78,;36.48,-43.48,;37.82,-44.25,;37.81,-45.78,;39.14,-46.56,;40.48,-45.79,;40.49,-44.25,;39.15,-43.48,;39.16,-41.95,;37.83,-41.18,;37.83,-39.63,;39.16,-38.86,;39.15,-37.32,;40.49,-39.63,;40.5,-41.18,;41.82,-38.85,;43.16,-39.62,;41.82,-37.31,;43.15,-38.07,)|
Cn1ncc(Cl)c1-c1oc(cc1Br)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1 |r,wU:16.17,wD:21.24,(68.33,-6.77,;68.01,-8.27,;66.6,-8.89,;66.76,-10.43,;68.26,-10.75,;68.88,-12.16,;69.04,-9.42,;70.57,-9.26,;71.6,-10.41,;73.01,-9.78,;72.85,-8.26,;71.34,-7.93,;70.72,-6.52,;74.34,-10.55,;74.34,-12.09,;75.68,-9.79,;77.01,-10.56,;77,-12.09,;78.33,-12.87,;79.67,-12.1,;79.68,-10.56,;78.34,-9.79,;78.35,-8.26,;77.02,-7.49,;77.02,-5.94,;78.35,-5.17,;78.34,-3.63,;79.68,-5.94,;79.69,-7.49,)|
Cn1ncc(Cl)c1-c1ccc(o1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1 |r|
Cn1cc(cn1)-c1coc(c1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1 |r|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CNCC[C@H]1c1cccc(c1)C(F)(F)F |r,wU:16.17,wD:21.24,(26.53,-8.06,;26.2,-9.57,;24.8,-10.19,;24.95,-11.72,;26.46,-12.05,;27.08,-13.45,;27.23,-10.71,;28.77,-10.56,;29.79,-11.71,;31.2,-11.09,;31.05,-9.55,;29.54,-9.23,;28.92,-7.82,;32.53,-11.86,;32.52,-13.4,;33.86,-11.09,;35.19,-11.87,;35.19,-13.4,;36.52,-14.18,;37.86,-13.41,;37.87,-11.86,;36.53,-11.1,;36.54,-9.56,;35.2,-8.79,;35.21,-7.25,;36.54,-6.48,;37.87,-7.24,;37.88,-8.79,;39.2,-6.47,;40.54,-7.23,;39.2,-4.93,;40.53,-5.69,)|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)NC1CNCC1c1ccc(cc1)C(F)(F)F |(7.46,-36.1,;7.13,-37.61,;5.73,-38.23,;5.88,-39.76,;7.39,-40.09,;8.01,-41.49,;8.16,-38.75,;9.7,-38.6,;10.72,-39.75,;12.13,-39.12,;11.97,-37.59,;10.47,-37.27,;9.85,-35.86,;13.46,-39.9,;13.45,-41.44,;14.79,-39.13,;16.12,-39.91,;16.29,-41.44,;17.79,-41.76,;18.57,-40.43,;17.54,-39.28,;17.86,-37.78,;19.33,-37.31,;19.65,-35.81,;18.51,-34.78,;17.04,-35.25,;16.72,-36.76,;18.83,-33.27,;20.3,-32.8,;17.69,-32.24,;19.23,-31.77,)|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)NC1CNCCC1c1ccccc1
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CCN2CCOCC2)C[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,19.21,wD:29.33,(61.2,-37.04,;60.88,-38.54,;59.47,-39.16,;59.63,-40.7,;61.13,-41.02,;61.76,-42.43,;61.91,-39.69,;63.44,-39.53,;64.47,-40.68,;65.88,-40.05,;65.72,-38.52,;64.22,-38.2,;63.59,-36.79,;67.22,-40.83,;67.21,-42.37,;68.55,-40.06,;69.88,-40.83,;69.88,-42.37,;71.21,-43.14,;72.55,-42.38,;73.88,-43.15,;75.21,-42.39,;76.54,-43.16,;76.53,-44.7,;77.85,-45.47,;79.19,-44.72,;79.2,-43.17,;77.87,-42.39,;72.55,-40.83,;71.22,-40.07,;71.22,-38.54,;69.89,-37.77,;69.89,-36.22,;71.22,-35.45,;71.21,-33.91,;72.55,-36.21,;73.88,-35.44,;72.56,-37.76,)|
Cn1nccc1-c1csc(c1)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1 |r|
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)NC1CNCCC1c1ccc(Cl)cc1
Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CC(=O)NCC(O)CO)C[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,19.21,wD:30.33,(62.66,-40.72,;62.33,-42.23,;60.93,-42.85,;61.08,-44.38,;62.59,-44.71,;63.21,-46.12,;63.36,-43.38,;64.9,-43.22,;65.92,-44.36,;67.34,-43.74,;67.18,-42.21,;65.67,-41.88,;65.05,-40.48,;68.67,-44.51,;68.67,-46.05,;70.01,-43.75,;71.34,-44.52,;71.33,-46.05,;72.66,-46.83,;74,-46.06,;75.33,-46.84,;76.67,-46.07,;76.67,-44.53,;78,-46.85,;79.34,-46.08,;80.67,-46.86,;80.66,-48.4,;82,-46.09,;83.33,-46.87,;74.01,-44.52,;72.68,-43.75,;72.67,-42.22,;71.34,-41.45,;71.34,-39.91,;72.67,-39.14,;72.67,-37.6,;74.01,-39.9,;75.34,-39.13,;74.01,-41.45,)|
COc1cc(ccc1OCc2ccc(cc2)C3CC3)C4CN(C4)C(=O)c5cc(ccn5)COC[C@H](CO)O
Nc1ncccc1-c1nc2ccc(nc2n1-c1ccc(cc1)C1(N)CCC1)-c1ccccc1
Cc1cc2nc(-c3cccnc3N)n(-c3ccc(CN)cc3)c2nc1C
Nc1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(cc3)C3(N)CCC3)c2n1
Nc1ncccc1-c1nc2ccc(nc2n1-c1ccc(cc1)C1(N)CCC1)-c1cccnc1
Cc1cnc2n(c(nc2c1)-c1cccnc1N)-c1ccc(CN)cc1
NCc1ccc(cc1)-n1c(nc2ccc(Cl)nc12)-c1cccnc1N
NCc1ccc(cc1)-n1c(nc2cc(Br)cnc12)-c1cccnc1N
CC(=O)Nc1ccc(cc1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(CN)cc3)c2n1
NCc1ccc(cc1)-n1c(nc2cc(cnc12)-c1cccnc1)-c1cccnc1N
CC(C)(N)c1ccc(cc1)-n1c(nc2ccc(nc12)-c1ccccc1)-c1cccnc1N
NC(=O)C1(CCC1)c1ccc(cc1)-n1c(nc2ccc(nc12)-c1ccccc1)-c1cccnc1N
CC(=O)Nc1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(cc3)C3(N)CCC3)c2n1
Cc1ccc(cc1)-n1c(nc2cccnc12)-c1cccnc1N
NCc1ccc(cc1)-n1c(nc2ccc(nc12)-c1ccccc1)-c1cccnc1N
CC(=O)NC1(CCC1)c1ccc(cc1)-n1c(nc2ccc(nc12)-c1ccccc1)-c1cccnc1N
NCc1ccc(cc1)-n1c(nc2ccc(nc12)-c1cn[nH]c1)-c1cccnc1N
Cc1ccnc2n(c(nc12)-c1cccnc1N)-c1ccc(CN)cc1
CC(=O)Nc1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(CN)cc3)c2n1
COC(=O)C1(CCC1)c1ccc(cc1)-n1c(nc2ccc(nc12)-c1ccccc1)-c1cccnc1N
Cn1cc(cn1)-c1cnc2c(cnn2c1)-c1csc(c1)C(=O)NCC(F)(F)F
Cc1sc(cc1-c1cnn2cc(Cl)cnc12)C(=O)N[C@@H]1[C@H](N)CCCC1(F)F |r|
FC(F)(F)CNC(=O)c1cc(cs1)-c1cnn2cc(cnc12)-c1ccc(OCCN2CCCCC2)cc1
Cn1cc(cn1)-c1cnc2c(cnn2c1)-c1csc(c1)C(=O)N[C@@H]1CCCC[C@@H]1N |r|
Oc1nc2ccc(Cl)cc2c(-c2ccccc2)c1C(=O)\C=C\c1nc2ccccc2[nH]1
Cc1ccc2[nH]c(\C=C\C(=O)c3c(-c4ccccc4)c4cc(Cl)ccc4[nH]c3=O)nc2c1
Clc1ccc2[nH]c(=O)c(C(=O)\C=C\c3nc4cc(Br)ccc4[nH]3)c(-c3ccccc3)c2c1
Fc1ccc2[nH]c(\C=C\C(=O)c3c(-c4ccccc4)c4cc(Cl)ccc4[nH]c3=O)nc2c1
O=C(\C=C\c1nc2ccccc2[nH]1)c1c(-c2ccccc2)c2ccccc2[nH]c1=O
Brc1ccc2[nH]c(=O)c(C(=O)\C=C\c3nc4ccccc4[nH]3)c(-c3ccccc3)c2c1
Cc1ccc2[nH]c(=O)c(C(=O)\C=C\c3nc4ccccc4[nH]3)c(-c3ccccc3)c2c1
Cn1c2ccc(Cl)cc2c(-c2ccccc2)c(C(=O)\C=C\c2nc3cc(F)ccc3[nH]2)c1=O
Fc1ccc(cc1)-c1c(C(=O)\C=C\c2nc3cc(F)ccc3[nH]2)c(=O)[nH]c2ccc(F)cc12
Fc1ccc(cc1)-c1c(C(=O)\C=C\c2nc3cc(F)c(F)cc3[nH]2)c(=O)[nH]c2ccc(F)cc12
Fc1ccc(cc1)-c1c(C(=O)\C=C\c2nc3cc(F)c(F)cc3[nH]2)c(=O)[nH]c2ccc(Cl)cc12
Fc1ccc2[nH]c(=O)c(C(=O)\C=C\c3nc4cc(F)c(F)cc4[nH]3)c(-c3ccc(F)c(F)c3)c2c1
COc1cccc(Cn2cnc3ccc(cc3c2=O)-c2cn[nH]c2)c1
COc1cccc(Cn2ncc3ccc(cc3c2=O)-c2cn[nH]c2)c1
COc1cc2cc(COCc3c(nc(nc3-c3ccc(F)cc3)N(C)S(C)(=O)=O)C(C)C)oc(=O)c2cc1OC
COc1cc2C(=O)O\C(=C/COCc3c(nc(nc3-c3ccc(F)cc3)N(C)S(C)(=O)=O)C(C)C)c2cc1OC
CC(C)Oc1cc(C2CCN(C)CC2)c(C)cc1Nc1nc(Nc2ccccc2S(=O)(=O)C(C)C)c2c(C)[nH]nc2n1
Cc1c(CN2CCN(CC2)C(=O)c2cc3cccc(C(N)=O)c3o2)sc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1
Cc1c(CN2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)sc2c(nc(nc12)-c1cnc(N)nc1)N1CCOCC1
Cn1nccc1-c1ccc(cc1F)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(F)c(F)c1
Cn1nccc1-c1cc(F)c(cc1F)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(F)c(F)c1
Cn1nccc1-c1cc(F)c(C(=O)N[C@@H]2CNCC[C@H]2c2ccc(F)c(F)c2)c(Cl)c1
Cn1nccc1-c1cc(F)c(C(=O)N[C@@H]2CNCC[C@H]2c2ccc(F)c(F)c2)c(F)c1
Cn1ncc(Cl)c1-c1cc(F)c(C(=O)N[C@@H]2CNCC[C@H]2c2ccc(F)c(F)c2)c(F)c1
Cn1ncc(Br)c1-c1cc(F)c(C(=O)N[C@@H]2CNCC[C@H]2c2ccc(F)c(F)c2)c(F)c1
Cn1ncc(Cl)c1-c1cc(F)c(cc1F)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(F)c(F)c1
Cn1ncc(Br)c1-c1cc(F)c(cc1F)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(F)c(F)c1
Cn1ncc(Cl)c1-c1cc(F)c(C(=O)N[C@@H]2CNCC[C@H]2c2ccc(F)c(F)c2)c(Cl)c1
Cn1ncc(Br)c1-c1cc(F)c(C(=O)N[C@@H]2CNCC[C@H]2c2ccc(F)c(F)c2)c(Cl)c1
Cn1nccc1-c1cc(F)c(C(=O)N[C@@H]2CNCC[C@H]2c2ccc(F)cc2)c(F)c1
Cn1nccc1-c1cc(F)c(cc1F)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(F)cc1
Cn1nccc1-c1ccc(C(=O)N[C@@H]2CNCC[C@H]2c2cc(F)cc(F)c2)c(Cl)c1
Cn1nccc1-c1ccc(C(=O)N[C@@H]2CNCC[C@H]2c2cc(F)cc(F)c2)c(F)c1
Cn1nccc1-c1ccc(cc1F)C(=O)N[C@@H]1CNCC[C@H]1c1cc(F)cc(F)c1
Cn1nccc1-c1ccc(C(=O)N[C@@H]2CNCC[C@H]2c2ccc(F)c(F)c2)c(Cl)c1
Cn1nccc1-c1ccc(C(=O)N[C@@H]2CNCC[C@H]2c2ccc(F)c(F)c2)c(F)c1
Fc1ccc(cc1F)[C@@H]1CCNC[C@H]1NC(=O)c1ccc(cc1F)-c1ccn[nH]1
CCn1nccc1-c1ccc(C(=O)N[C@@H]2CNCC[C@H]2c2ccc(F)c(F)c2)c(F)c1
NC(=O)c1cccc2c(NCc3ccc4OCOc4c3)ncnc12
NC(=O)c1cccc2c(NCc3ccc4OCOc4c3)ccnc12
NC(=O)c1cccc2c(NCc3ccc4OCOc4c3)nccc12
CNCC(Nc1ncnc2c(cccc12)C(N)=O)c1cccc(F)c1
CNC[C@H](c1cccc(c1)F)Nc2c3cccc(c3ncn2)C(=O)N
NC(=O)c1cccc2c(N[C@H](CN3CCC3)c3cccc(F)c3)ncnc12 |r|
NC(=O)c1cccc2c(N[C@H](CN3CCCC3)c3cccc(F)c3)ncnc12 |r|
NC(=O)c1cccc2c(N[C@H](CN3CCC3)c3cccc(Cl)c3)ncnc12 |r|
NC(=O)c1cccc2c(N[C@H](CN3CCC3)c3cccc(c3)C(F)(F)F)ncnc12 |r|
NC(=O)c1cccc2c(N[C@H](CN3CCC3)c3ccc(F)cc3)ncnc12 |r|
NC(=O)c1cccc2c(N[C@H](CN3CCC3)c3ccc(cc3)C(F)(F)F)ncnc12 |r|
NC(=O)c1cccc2c(N[C@H](CN3CCC3)c3ccc(F)c(F)c3)ncnc12 |r|
NC(=O)c1cccc2c(N[C@H](CN3CCC3)c3ccc(Cl)c(F)c3)ncnc12 |r|
NC(=O)c1cccc2c(N[C@H](CN3CCC3)c3ccc(F)c(c3)C(F)(F)F)ncnc12 |r|
c1cc2c(c(c1)C(=O)N)ncnc2N[C@H](CN3CCC3)c4ccc(c(c4)C(F)(F)F)Cl
CNC[C@@H](Nc1nc(C)nc2c(cccc12)C(N)=O)c1cccc(F)c1 |r|
CCc1nc(N[C@H](CNC)c2cccc(F)c2)c2cccc(C(N)=O)c2n1 |r|
CNC[C@@H](Nc1nc(nc2c(cccc12)C(N)=O)C(F)(F)F)c1cccc(F)c1 |r|
CC(C)C[C@@H](NC(=O)C1(N)CCN(CC1)c1ncnc2[nH]ccc12)C(=O)NO
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)N[C@@H](C(=O)NO)c1ccccc1
Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCCCCCCCC(=O)N2CCN(CC[C@H](NC(=O)C3(N)CCN(CC3)c3ncnc4[nH]ccc34)c3ccc(Cl)cc3)CC2)C(C)(C)C)cc1 |r|
NC1(CCN(CC1)c1ncnc2[nH]ccc12)C(=O)N[C@@H](CCN1CCN(CC1)C(=O)CCOCCOCCOCCOCCOCCNc1cccc2C(=O)N(C3CCC(=O)NC3=O)C(=O)c12)c1ccc(Cl)cc1 |r|
Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@H](CN2C(=O)[C@@H](NC(=O)CCCCCCCCCCC(=O)N2CCN(CC[C@H](NC(=O)C3(N)CCN(CC3)c3ncnc4[nH]ccc34)c3ccc(Cl)cc3)CC2)C(C)(C)C)OCc2ccccc2)cc1 |r|
CN1C(=O)CCC(N2C(=O)c3cccc(NCCOCCOCCOCCOCCOCCC(=O)N4CCN(CC[C@H](NC(=O)C5(N)CCN(CC5)c5ncnc6[nH]ccc56)c5ccc(Cl)cc5)CC4)c3C2=O)C1=O |r|
C[C@H](NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H](NC(=O)CCCCCCCCCCC(=O)NCCNC[C@@H](C(=O)N1CCN(CC1)c1ncnc2[C@H](O)C[C@@H](C)c12)c1ccc(Cl)cc1)C(C)(C)C)c1ccc(cc1)-c1scnc1C |r|
C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(CC3)C(=O)[C@H](CNCCC(=O)NCCCCCCCCNc3cccc4C(=O)N(C5CCC(=O)NC5=O)C(=O)c34)c3ccc(Cl)cc3)c12 |r|
C[C@H](NC(=O)[C@H]1C[C@H](O)CN1C(=O)[C@@H](NC(=O)CCCCCCCCCCC(=O)NCCNC[C@@H](C(=O)N1CCN(CC1)c1ncnc2[C@H](O)C[C@@H](C)c12)c1ccc(Cl)cc1)C(C)(C)C)c1ccc(cc1)-c1scnc1C |r|
C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(CC3)C(=O)[C@H](CNCCC(=O)NCCCCCCCCNc3cccc4C(=O)N(C5CCC(=O)N(C)C5=O)C(=O)c34)c3ccc(Cl)cc3)c12 |r|
COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cccc(NC(=O)C=C)c3)c2n1)N1CCN(CCCCCCNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1 |TLB:49:50:47.48.53:54,THB:49:48:54:55.50.51,51:50:47:53.52.54,51:52:47:55.49.50|
COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cccc(NC(=O)C=C)c3)c2n1)N1CCN(CCCCCCCCNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1 |TLB:51:52:49.50.55:56,THB:51:50:56:57.52.53,53:52:49:55.54.56,53:54:49:57.51.52|
COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cccc(NC(=O)C=C)c3)c2n1)N1CCN(CCCCCCCCCCNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1 |TLB:53:54:51.52.57:58,THB:53:52:58:59.54.55,55:54:51:57.56.58,55:56:51:59.53.54|
COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cccc(NC(=O)C=C)c3)c2n1)N1CCN(CCCCCCCCCCCCNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1 |TLB:55:56:53.54.59:60,THB:55:54:60:61.56.57,57:56:53:59.58.60,57:58:53:61.55.56|
COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cccc(NC(=O)C=C)c3)c2n1)N1CCN(CCCCCCCCCCCCCCNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1 |TLB:57:58:55.56.61:62,THB:59:58:55:61.60.62,59:60:55:63.58.57,57:56:62:63.58.59|
COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cccc(NC(=O)C=C)c3)c2n1)N1CCN(CCOCCOCCNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1 |TLB:51:52:49.50.55:56,THB:51:50:56:57.52.53,53:52:49:55.54.56,53:54:49:57.52.51|
COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cccc(NC(=O)C=C)c3)c2n1)N1CCN(CC1)C(=O)CCCCCCCCCCCNC(=O)CC12CC3CC(CC(C3)C1)C2 |TLB:58:59:56.57.62:63,THB:60:59:56:62.61.63,60:61:56:64.59.58,58:57:63:64.59.60|
COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cccc(N)c3)c2n1)N1CCN(CCCCCCCCCCCCNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1 |TLB:51:52:49.50.55:56,THB:51:50:56:57.52.53,53:52:49:55.54.56,53:54:49:57.52.51|
COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cccc(NC(C)=O)c3)c2n1)N1CCN(CCCCCCCCCCCCNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1 |TLB:54:55:52.53.58:59,THB:54:53:59:60.55.56,56:55:52:58.57.59,56:57:52:60.55.54|
CCC(=O)Nc1cccc(c1)-n1c2nc(Nc3ccc(cc3OC)N3CCN(CCCCCCCCCCCCNC(=O)CC45CC6CC(CC(C6)C4)C5)CC3)ncc2c(C)cc1=O |TLB:47:48:45.46.51:52,THB:47:46:52:53.48.49,49:48:45:51.50.52,49:50:45:53.48.47|
COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cccc(NC(=O)C(C)C)c3)c2n1)N1CCN(CCCCCCCCCCCCNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1 |TLB:56:57:54.55.60:61,THB:58:57:54:60.59.61,58:59:54:62.57.56,56:55:61:62.57.58|
COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cccc(NC(=O)C4CC4)c3)c2n1)N1CCN(CCCCCCCCCCCCNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1 |TLB:56:57:54.55.60:61,THB:58:57:54:60.59.61,58:59:54:62.57.56,56:55:61:62.57.58|
COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cccc(NC(=O)C(C)(C)C)c3)c2n1)N1CCN(CCCCCCCCCCCCNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1 |TLB:57:58:55.56.61:62,THB:59:58:55:61.60.62,59:60:55:63.58.57,57:56:62:63.58.59|
COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3ccc(NC(=O)C=C)cc3)c2n1)N1CCN(CCCCCCCCCCCCNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1 |TLB:55:56:53.54.59:60,THB:55:54:60:61.56.57,57:56:53:59.58.60,57:58:53:61.56.55|
COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3ccc(NC(=O)C4CC4)cc3)c2n1)N1CCN(CCCCCCCCCCCCNC(=O)CC23CC4CC(CC(C4)C2)C3)CC1 |TLB:56:57:54.55.60:61,THB:58:57:54:60.59.61,58:59:54:62.57.56,56:55:61:62.57.58|
CC1=CC(=O)N(c2c1cnc(n2)Nc3ccc(cc3OC)N4CCN(CC4)C)c5cccc(c5)NC(=O)C=C
CC1(C)c2oc3cc(ccc3c2C(=O)c2ccc(OCCN3CCOCC3)cc12)C#Cc1cc(OCC2CC2)ccn1
Cc1cc(cc(n1)C#Cc2ccc3c(c2)oc4c3C(=O)c5ccc(cc5C4(C)C)NS(=O)(=O)C)C(=O)NC(C)(C)C
COc1cccc(c1)[C@@H](C)NC(=O)c1ccc(cc1)-c1ccnc(F)c1 |r|
COc1cccc(c1)[C@@H](C)NC(=O)c1ccc(nc1)-c1ccnc(F)c1 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc(CO)c1C)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1cc[nH]c(=O)c1)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2NC(=O)CCc12)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2NC(=O)CC(C)c12)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2NC(=O)CN(C)c12)c1ccc(Cl)cc1
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2NCC(=O)N(C)c12)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2NC(=O)C[C@H](C)c12)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2NC(=O)C[C@@H](C)c12)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2NC(=O)C[C@@H](c12)C(F)(F)F)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2NC(=O)C[C@H](c12)C(F)(F)F)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2NC(=O)C(C)Cc12)c1ccc(Cl)cc1
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2NC(=O)[C@H](C)Cc12)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2NC(=O)[C@@H](C)Cc12)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2NC(=O)OC(C)c12)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2NC(=O)O[C@H](C)c12)c1ccc(Cl)cc1
CC(C)NC[C@@H](C(=O)N1CCN(CC1)c1ncnc2NC(=O)O[C@@H](C)c12)c1ccc(Cl)cc1 |r|
[H][C@@]12C[C@]1([H])c1c(NC2=O)ncnc1N1CCN(CC1)C(=O)[C@H](CNC(C)C)c1ccc(Cl)cc1 |r|
[H][C@]12C[C@@]1([H])c1c(NC2=O)ncnc1N1CCN(CC1)C(=O)[C@H](CNC(C)C)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CCC(=CC1)c1ncnc2NC(=O)C[C@@H](C)c12)c1ccc(Cl)cc1 |r,c:11|
CC(C)NC[C@@H](C(=O)N1CCC(CC1)c1ncnc2NC(=O)C[C@@H](C)c12)c1ccc(Cl)cc1 |r|
[H][C@@]12CN(C[C@]1([H])CN(C2)c1ncnc2NC(=O)C[C@@H](C)c12)C(=O)[C@H](CNC(C)C)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CC2(C1)CN(C2)c1ncnc2NC(=O)C[C@@H](C)c12)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CCN([C@H](C)C1)c1ncnc2NC(=O)C[C@@H](C)c12)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CC2CC1CN2c1ncnc2NC(=O)C[C@@H](C)c12)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CCN(CC11CC1)c1ncnc2NC(=O)C[C@@H](C)c12)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CCN(C[C@@H]1C)c1ncnc2NC(=O)C[C@@H](C)c12)c1ccc(Cl)cc1
CC(C)NC[C@@H](C(=O)N1CCN(C[C@H]1C)c1ncnc2NC(=O)C[C@@H](C)c12)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1C2CCC1CN(C2)c1ncnc2NC(=O)C[C@@H](C)c12)c1ccc(Cl)cc1 |r|
CC(C)NC[C@@H](C(=O)N1CC2CCC(C1)N2c1ncnc2NC(=O)C[C@@H](C)c12)c1ccc(Cl)cc1 |r|
[H][C@]12CC[C@]([H])(CN(C1)c1ncnc3NC(=O)O[C@@H](C)c13)N2C(=O)[C@H](CNC(C)C)c1ccc(Cl)cc1 |r|
[H][C@]12CC[C@]([H])(CN(C1)C(=O)[C@H](CNC(C)C)c1ccc(Cl)cc1)N2c1ncnc2NC(=O)O[C@@H](C)c12 |r|
CC(C)NC[C@@H](C(=O)N1C2CCC1CN(C2)c1ncnc2NC(=O)CN(C)c12)c1ccc(Cl)cc1
[H][C@]12CC[C@]([H])(CN(C1)C(=O)[C@H](CNC(C)C)c1ccc(Cl)cc1)N2c1ncnc2NC(=O)CN(C)c12 |r|
[H][C@@]12C[C@]1([H])N(CCN2C(=O)[C@H](CNC(C)C)c1ccc(Cl)cc1)c1ncnc2NC(=O)CN(C)c12 |r|
[H][C@@]12C[C@]1([H])N(CCN2C(=O)[C@H](CNC1C2COCC12)c1ccc(Cl)cc1)c1ncnc2NC(=O)C[C@@H](C)c12 |r|
[H][C@@]12C[C@]1([H])N(CCN2C(=O)[C@H](CNC1CCC(CC1)OC)c1ccc(Cl)cc1)c1ncnc2NC(=O)C[C@@H](C)c12 |r,wU:11.13,1.0,3.4,wD:38.42,(3.08,-1.58,;2,-2.67,;3.33,-3.45,;2,-4.22,;3.48,-4.62,;.66,-5,;-.68,-4.22,;-.68,-2.67,;.66,-1.91,;.66,-.37,;1.99,.4,;-.67,.4,;-.67,1.94,;.66,2.71,;.66,4.25,;-.67,5.02,;-.67,6.56,;.66,7.33,;1.99,6.56,;1.99,5.02,;.66,8.87,;-.67,9.64,;-2.01,-.37,;-2,-1.91,;-3.34,-2.68,;-4.67,-1.92,;-6.01,-2.69,;-4.68,-.37,;-3.34,.4,;.66,-6.54,;-.68,-7.32,;-.68,-8.87,;.66,-9.64,;2,-8.87,;3.33,-9.64,;4.67,-8.87,;6.01,-9.64,;4.67,-7.32,;3.33,-6.54,;3.33,-5,;2,-7.32,)|
[H][C@@]12C[C@]1([H])N(CCN2C(=O)[C@H](CN)c1ccc(Cl)cc1)c1ncnc2NC(=O)C[C@@H](C)c12 |r|
C[C@H](NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H](NC(=O)CCCCCCCCCCNC(=O)CCc1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(cc3)C3(N)CCC3)c2n1)C(C)(C)C)c1ccc(cc1)-c1scnc1C |r|
C[C@H](NC(=O)[C@H]1C[C@H](O)CN1C(=O)[C@@H](NC(=O)CCCCCCCCCCNC(=O)CCc1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(cc3)C3(N)CCC3)c2n1)C(C)(C)C)c1ccc(cc1)-c1scnc1C |r|
C[C@H](NC(=O)[C@H]1C[C@@H](CN1C(=O)[C@@H](NC(=O)CCCCCCCCCCNC(=O)CCc1cccc(c1)-c1ccc2nc(-c3cccnc3N)n(-c3ccc(cc3)C3(N)CCC3)c2n1)C(C)(C)C)OCc1ccccc1)c1ccc(cc1)-c1scnc1C |r|
C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(CC3)C(=O)[C@H](CNCCCCCCCCCCCc3cccc4C(=O)N(Cc34)C3CCC(=O)NC3=O)c3ccc(Cl)cc3)c12 |r|
C[C@@H]1CCN(C[C@@H]1n1ccc2cnc3[nH]ccc3c12)C(=O)CC#N |r|
CCCCCCCCCCCCCCCCCOC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCC)COP(O)(=O)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](OP(O)(O)=O)[C@H]1O |r|
CCCCCCCCCOC(=O)O[C@H](COC(=O)CCCCCCCCC)COP(O)(=O)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](OP(O)(O)=O)[C@H]1O |r|
CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O |r|
CCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCC)O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O |r|
[H][C@]12COC(=O)[C@]1([H])[C@H](c1cc(OC)c(OC)c(OC)c1)c1cc3OCOc3cc1[C@@H]2OC(=O)Cc1ccc(NC(=O)COc2cccc(Cl)c2)cc1 |r|
Clc1ccc(cc1)C1(CCNCC1)c1ccc(cc1)-c1cn[nH]c1
Cc1c2c(nc(n1)N)N(C(=O)C(=C2)c3ccc(nc3)OC)C4CCC(CC4)OCCO
COc1ccc(cc1)C(=O)NNC(=O)c1cc2nc(nc(N3CCOCC3)c2s1)-c1cnc(N)nc1
Fc1ccc(cc1F)[C@@H]1CCNC[C@H]1NC(=O)c1ccc2-c3ccnn3CCOc2c1
Fc1cc(F)cc(c1)[C@@H]1CCNC[C@H]1NC(=O)c1ccc2-c3ccnn3CCOc2c1
Fc1cc(F)cc(c1)[C@@H]1CCNC[C@H]1NC(=O)c1ccc2-c3c(Cl)cnn3CCOc2c1
Fc1cc(cc(F)c1F)[C@@H]1CCNC[C@H]1NC(=O)c1ccc2-c3ccnn3CCOc2c1
Fc1cccc(c1)[C@@H]1CCNC[C@H]1NC(=O)c1cc-2c(CCCn3nccc-23)s1
Fc1cccc(c1)[C@@H]1CCNC[C@H]1NC(=O)c1cc-2c(CCCn3ncc(Cl)c-23)s1
Fc1cccc(c1)[C@@H]1CCNC[C@H]1NC(=O)c1cc-2c(CCCn3ncc(Br)c-23)s1
Fc1ccc(cc1F)[C@@H]1CCNC[C@H]1NC(=O)c1cc-2c(CCCn3ncc(Br)c-23)s1
Fc1cc(F)cc(c1)[C@@H]1CCNC[C@H]1NC(=O)c1cc-2c(CCCn3ncc(Br)c-23)s1
Fc1cccc(c1)[C@@H]1CCNC[C@H]1NC(=O)c1cc-2c(OCCn3ncc(Cl)c-23)s1
Fc1ccc(cc1F)[C@@H]1CCNC[C@H]1NC(=O)c1cc-2c(OCCn3nccc-23)s1
Fc1ccc(cc1F)[C@@H]1CCNC[C@H]1NC(=O)c1cc-2c(OCCn3ncc(Cl)c-23)s1
Fc1ccc(cc1F)[C@@H]1CCNC[C@H]1NC(=O)c1cc-2c(OCCn3ncc(Br)c-23)s1
Fc1cc(F)cc(c1)[C@@H]1CCNC[C@H]1NC(=O)c1cc-2c(OCCn3nccc-23)s1
Fc1cc(F)cc(c1)[C@@H]1CCNC[C@H]1NC(=O)c1cc-2c(OCCn3ncc(Br)c-23)s1
Fc1ccc(cc1F)[C@H]1CCNC[C@@H]1NC(=O)c1cc-2c(OCCn3ncc(Br)c-23)s1
Fc1cc(cc(F)c1F)[C@@H]1CCNC[C@H]1NC(=O)c1cc-2c(OCCn3ncc(Cl)c-23)s1
Fc1cc(cc(F)c1F)[C@@H]1CCNC[C@H]1NC(=O)c1cc-2c(OCCn3ncc(Br)c-23)s1
FC(F)(F)c1cc(ccc1Cl)[C@@H]1CCNC[C@H]1NC(=O)c1cc-2c(OCCn3ncc(Br)c-23)s1
FC(F)(F)c1ccc(cc1Cl)[C@@H]1CCNC[C@H]1NC(=O)c1cc-2c(OCCn3ncc(Br)c-23)s1
Clc1ccc(cc1)[C@@H]1CCNC[C@H]1NC(=O)c1cc-2c(OCCn3ncc(Br)c-23)s1
CCc1cnn2CCOc3sc(cc3-c12)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(F)c(F)c1
OCCc1cnn2CCOc3sc(cc3-c12)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(F)c(F)c1
Fc1ccc(cc1F)[C@@H]1CCN(C[C@H]1NC(=O)c1cc-2c(OCCn3ncc(Br)c-23)s1)C(=O)C=C |r|
CC(=O)N1CC[C@H]([C@@H](C1)NC(=O)c1cc-2c(OCCn3ncc(Br)c-23)s1)c1ccc(F)c(F)c1 |r|
Fc1ccc(cc1F)[C@@H]1CCN(C[C@H]1NC(=O)c1cc-2c(OCCn3ncc(Br)c-23)s1)C(=O)c1ccc(Cl)cc1 |r|
Fc1ccc(cc1F)[C@@H]1CCN(C[C@H]1NC(=O)c1cc-2c(OCCn3ncc(Br)c-23)s1)C(=O)c1ccccc1 |r|
Cc1ccc(cc1)C(=O)N1CC[C@H]([C@@H](C1)NC(=O)c1cc-2c(OCCn3ncc(Br)c-23)s1)c1ccc(F)c(F)c1 |r|
Fc1ccc(cc1F)[C@@H]1CCN(C[C@H]1NC(=O)c1cc-2c(OCCn3ncc(Br)c-23)s1)C(=O)Cc1ccccc1 |r|
COc1ccc(cc1)S(=O)(=O)N1CC[C@H]([C@@H](C1)NC(=O)c1cc-2c(OCCn3ncc(Br)c-23)s1)c1ccc(F)c(F)c1 |r|
COc1ccc(\C=C/c2cc(OC)c(OC)c(OC)c2)cc1NC(=O)CCC(=O)N[C@@H](CCCNC(N)=N)C(O)=O |r|
CN1CCC2=C1C1C(=O)NC(c3ccccc3)=NC1S2
CCOC(=O)c1c(NC(=S)Nc2cc(C)ccc2Cl)sc2c1N(C)CC2
N#CCc1ccc(Nc2nccc(Nc3cc([nH]n3)C3CC3)n2)cc1
Cc1ncsc1-c1ccc(C(C)NC(=O)C2CC(O)CN2C(=O)C(NC(=O)CCCCCCCCCCNC(=O)CCc2cccc(-c3ccc4nc(-c5cccnc5N)n(-c5ccc(C6(N)CCC6)cc5)c4n3)c2)C(C)(C)C)cc1
NC1(C(=O)N[C@@H](CCO)c2ccc(Cl)cc2)CCN(c2nc[nH]c3nccc2-3)CC1
O=C1NC(=O)C(Cc2ccc3nccc(-c4ccncc4)c3c2)S1
c1cc(-c2ccnc3ccc(-c4cnc5[nH]ncc5c4)cc23)ccn1
Nc1ncc(-c2ccc3nccc(-c4ccncc4)c3c2)cc1S(N)(=O)=O
O=S(=O)(Nc1cncc(-c2ccc3nccc(-c4ccncc4)c3c2)c1)c1ccccc1F
Cc1nc(-c2ccc(CN3CCC(n4c(=O)[nH]c5ccc(N)cc54)CC3)cc2)c(-c2ccccc2)[nH]c1=O
Cc1nc(-c2ccccc2)c(-c2ccc(CN3CCC(n4c(=O)[nH]c5ccc(N)cc54)CC3)cc2)[nH]c1=O
CC(C)Cc1nc(-c2ccc(CN3CCC(n4c(=O)[nH]c5ccc(N)cc54)CC3)cc2)c(-c2ccccc2)[nH]c1=O
C=CC(=O)Nc1ccc2[nH]c(=O)n(C3CCN(Cc4ccc(-c5nc(CC(C)C)c(=O)[nH]c5-c5ccccc5)cc4)CC3)c2c1
CC(C)Cc1nc(-c2ccccc2)c(-c2ccc(CN3CCC(n4c(=O)[nH]c5ccc(N)cc54)CC3)cc2)[nH]c1=O
C=CC(=O)Nc1ccc2[nH]c(=O)n(C3CCN(Cc4ccc(-c5[nH]c(=O)c(CC(C)C)nc5-c5ccccc5)cc4)CC3)c2c1
Nc1ccc2[nH]c(=O)n(C3CCN(Cc4ccc(-c5nc(Cc6ccc(O)cc6)c(=O)[nH]c5-c5ccccc5)cc4)CC3)c2c1
C=CC(=O)Nc1ccc2[nH]c(=O)n(C3CCN(Cc4ccc(-c5nc(Cc6ccc(O)cc6)c(=O)[nH]c5-c5ccccc5)cc4)CC3)c2c1
Nc1ccc2[nH]c(=O)n(C3CCN(Cc4ccc(-c5[nH]c(=O)c(Cc6ccc(O)cc6)nc5-c5ccccc5)cc4)CC3)c2c1
C=CC(=O)Nc1ccc2[nH]c(=O)n(C3CCN(Cc4ccc(-c5[nH]c(=O)c(Cc6ccc(O)cc6)nc5-c5ccccc5)cc4)CC3)c2c1
C[C@@H](C(F)(F)F)N(Cc1ccc(cc1)F)C(=O)CN2C(=O)[C@]3(CCc4c3ccc(c4)NC(=O)NC)OC2=O
Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2c1cnn2C
Cc1cc2c(c[nH]c2nc1)Cc3ccc(nc3F)NCc4cc(cnc4OC)F
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)NC)OC
COc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)/C=C/CN(C)C
CCOc1cc(ccc1Nc2ncc3c(n2)N(c4ccccc4C(=O)N3C)C)N5CCC(CC5)O
C[C@@]1(O)C[C@@H](C1)c1nc(-c2ccc3ccc(nc3c2)-c2ccccc2)c2c(N)nccn12 |r,wU:1.1,4.6,wD:1.0,(18.42,-37.26,;17.1,-36.49,;16.31,-37.82,;17.79,-35.11,;16.41,-34.42,;15.72,-35.8,;15.93,-32.97,;16.83,-31.71,;15.91,-30.47,;16.38,-29.01,;15.35,-27.88,;15.81,-26.41,;17.32,-26.08,;17.78,-24.62,;19.27,-24.29,;20.31,-25.42,;19.85,-26.89,;18.35,-27.21,;17.89,-28.68,;21.81,-25.09,;22.85,-26.23,;24.35,-25.9,;24.82,-24.43,;23.77,-23.29,;22.27,-23.63,;14.45,-30.96,;13.11,-30.19,;13.11,-28.65,;11.78,-30.96,;11.78,-32.51,;13.12,-33.28,;14.46,-32.5,)|
C=CC(=O)Nc1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
Cc1cn(CCN2CCN(CC2)c2ccccc2-c2cc(cc(c2)C(=O)NCCCN2CCCC2)C#N)c2ccccc12
CCc1cc(Nc2nccc(n2)-c2c(nc3ccccn23)-c2ccc(OC)c(c2)C(=O)Nc2c(F)cccc2F)c(OC)cc1N1CCC(CC1)N1CCN(CC1)S(C)(=O)=O
CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc4ncccc4c3)C(C)(C)C)c(F)c2)ccn1
c1cc(c(cc1I)F)Nc2c(ccc(c2F)F)C(=O)N3CC(C3)([C@@H]4CCCCN4)O
CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3cc(F)c4nc(C)n(C(C)C)c4c3)nc2)CC1
O=C(NCC#N)c1ccc(cc1)-c1ccnc(Nc2ccc(cc2)N2CCOCC2)n1
CCc1cccc(CC)c1NC(=O)c1nn(C)c-2c1CCc1cnc(Nc3ccc(cc3OC(F)(F)F)C(=O)NC3CCN(C)CC3)nc-21
O=C1c2ccccc2-c2n[nH]c3cccc1c23
CC[C@@H]1CN(C[C@@H]1c1cnc2cnc3[nH]ccc3n12)C(=O)NCC(F)(F)F |r|
C=CC(=O)Nc1cc2c(cc1Cl)[nH]c(=O)n2C1CCN(Cc2ccc(-c3nc4cc[nH]c(=O)c4cc3-c3ccccc3)cc2)CC1
C=CC(=O)Nc1ccc(C(=O)NC2CCN(Cc3ccc(-c4nc5cc[nH]c(=O)c5cc4-c4ccccc4)cc3)CC2)c(F)c1
C=CC(=O)Nc1cc(Br)cc(C(=O)NC2CCN(Cc3ccc(-c4nc5cc[nH]c(=O)c5cc4-c4ccccc4)cc3)CC2)c1
C=CC(=O)Nc1ccc(C(=O)NC2CCN(Cc3ccc(-c4nc5cc[nH]c(=O)c5cc4-c4ccccc4)cc3)CC2)s1
C=CC(=O)Nc1ccc(C2CCN(Cc3ccc(-c4nc5cc[nH]c(=O)c5cc4-c4ccccc4)cc3)CC2)cc1
C=CC(=O)Nc1cccc(CNC2CCN(Cc3ccc(-c4nc5cc[nH]c(=O)c5cc4-c4ccccc4)cc3)CC2)c1
CC(NCc1ccc(cc1)C(=O)Nc1ncc(SCc2cc(C)c(C)c(c2)C(=O)N2CCN(CC2)C(C)=O)s1)C(C)(C)C
Cc1c[nH]c2nccc(Oc3c(F)cc(Nc4cc(Cl)nc(N)n4)cc3F)c12