5375 SMILES Strings for Histamine H3 receptor

Compound Name
SMILES String
CC1(C)COC(=N1)c1cccc(Cc2cnc[nH]2)c1 |c:5|
N#Cc1cccc(Cc2cnc[nH]2)c1
C(c1cnc[nH]1)c1ccccc1
C(c1cnc[nH]1)c1cccc(c1)-c1ccccc1
C(c1cnc[nH]1)c1cccc(c1)-c1ccccn1
C(c1cnc[nH]1)c1cccc(c1)-c1ccncc1
CC(C)(C)CC(=O)c1cccc(Cc2cnc[nH]2)c1
CC(C)(C)C#Cc1cccc(Cc2cnc[nH]2)c1
C(c1cnc[nH]1)c1cccc(c1)C#Cc1ccccc1
C(c1cnc[nH]1)c1cccc(c1)C#Cc1cccc2ccccc12
CCCC#Cc1cccc(Cc2cnc[nH]2)c1
NC(SCCCc1cnc[nH]1)=NCc1ccc(Cl)cc1 |w:11.12|
c1c([nH]cn1)CC2CCNCC2
CC1(C)COC(=N1)c1ccc(Cc2cnc[nH]2)cc1 |c:5|
N#Cc1ccc(Cc2cnc[nH]2)cc1
Brc1ccc(Cc2cnc[nH]2)cc1
CC(C)(C)C#Cc1ccc(Cc2cnc[nH]2)cc1
Nc1ccc(Cc2cnc[nH]2)cc1
CC1CC(C)(C)N=C(O1)c1cccc(Cc2cnc[nH]2)c1 |c:6|
C(c1cnc[nH]1)c1cccc(c1)C1=NC2(CCCC2)CO1 |t:14|
C(c1cnc[nH]1)c1cccc(c1)C1=NCC2(CCCCC2)O1 |t:14|
C(C1COC(=N1)c1cccc(Cc2cnc[nH]2)c1)C1CCCCC1 |c:4|
C([C@@H]1COC(=N1)c1cccc(Cc2cnc[nH]2)c1)c1ccccc1 |r,c:4|
CC1(C)COC(=NC1)c1cccc(Cc2cnc[nH]2)c1 |c:5|
CN1CCN(CC1)C(=O)c1cc2cc(Cl)ccc2[nH]1
NCCc1cnc[nH]1
CNCCc1cnc[nH]1
C[C@@H](N)Cc1cnc[nH]1 |r|
C[C@H](N)Cc1cnc[nH]1
NCCCc1cnc[nH]1
NCCCCc1cnc[nH]1
NCCCCCc1cnc[nH]1
CN1CCC(Cc2cnc[nH]2)CC1
C(c1cnc[nH]1)c1ccncc1
[H]/N=C(\N)/SCCc1cnc[nH]1
NC(=N)SCCCc1cnc[nH]1
NC(SCCCc1cnc[nH]1)=NCCc1ccc(I)cc1 |w:11.12|
Cc1nc[nH]c1CSCCN=C(N)NCCCc1cnc[nH]1 |w:10.10|
CNC(=S)NCCCCc1cnc[nH]1
S=C(NC1CCCCC1)N1CCC(CC1)c1cnc[nH]1
c1ccc(cc1)COCCCc2cnc[nH]2
Ic1ccc(COCCCc2cnc[nH]2)cc1
[H][C@]12CCCC[C@@]1([H])C1=C(CCc3c(nc(N)nc13)N1CCNCC1)O2 |r,t:9|
CN1CCN(CC1)c1cc(nc(N)n1)-c1ccc(cc1)C#N
Nc1nc(cc(n1)-c1ccc(cc1)C#N)N1CCNCC1
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)N(C)C)[C@]2([H])CC[C@]13[H] |r,t:14|
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)NC)[C@]2([H])CC[C@]13[H] |r,t:14|
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)N(C)C(C)=O)[C@]2([H])CC[C@]13[H] |r,t:14|
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)N(C)C(=O)C4CC4)[C@]2([H])CC[C@]13[H] |r,t:14|
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)N(C)C(=O)c4ccccc4)[C@]2([H])CC[C@]13[H] |r,t:14|
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)N(C)C(=O)c4ccc(cc4)C#N)[C@]2([H])CC[C@]13[H] |r,t:14|
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)N(C)C(=O)c4ccncc4)[C@]2([H])CC[C@]13[H] |r,t:14|
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)N(C)C(=O)Cc4cccs4)[C@]2([H])CC[C@]13[H] |r,t:14|
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)N(C)c4ccc(cc4)C#N)[C@]2([H])CC[C@]13[H] |r,t:14|
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)N(C)C(=O)OC)[C@]2([H])CC[C@]13[H] |r,t:14|
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)N(C)C(=O)N(C)C)[C@]2([H])CC[C@]13[H] |r,t:14|
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)N(C)S(=O)(=O)N(C)C)[C@]2([H])CC[C@]13[H] |r,t:14|
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)N(C)S(=O)(=O)CC)[C@]2([H])CC[C@]13[H] |r,t:14|
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)N(C)S(=O)(=O)c4ccccc4)[C@]2([H])CC[C@]13[H] |r,t:14|
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)N(C)S(=O)(=O)c4ccc(cc4)C#N)[C@]2([H])CC[C@]13[H] |r,t:14|
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)N(C)C(=O)[C@@H](N)[C@@H](C)CC)[C@]2([H])CC[C@]13[H] |r,t:14|
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)N(C)C(=O)[C@H](N)[C@H](C)CC)[C@]2([H])CC[C@]13[H] |r,t:14|
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)N(C)C(=O)[C@H](NC)C(C)C)[C@]2([H])CC[C@]13[H] |r,t:14|
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)N(C)C(=O)[C@H](CC(C)C)NC(C)=O)[C@]2([H])CC[C@]13[H] |r,t:14|
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)N(C)C(=O)[C@H](Cc4ccccc4)NC(C)=O)[C@]2([H])CC[C@]13[H] |r,t:14|
O=C(C1CC1)c1ccc(OCCCc2cnc[nH]2)cc1
[H][C@@]1(C)N(C)C[C@]23CC[C@@]4([H])[C@@]([H])(CC=C5C[C@H](CC[C@]45C)N(C)C(=O)OCC(Cl)(Cl)Cl)[C@]2([H])CC[C@]13[H] |r,t:14|
[H][C@]12CC[C@@]3([H])[C@]4([H])CC=C5C[C@H](CC[C@]5(C)[C@@]4([H])CC[C@]13CN(C)C2=O)N(C)C |r,t:9|
C(Cc1cnc[nH]1)N1CCCC1
C[C@H](N)Cc1cnc[nH]1 |r|
Cc1ccc(Cn2nc(cc2-c2ccc(Cl)c(C)c2)C(=O)NC2[C@@]3(C)CCC(C3)C2(C)C)cc1 |r,TLB:21:22:28:26.25|
C(CC1CCCCC1)C=CCCc1cnc[nH]1 |w:9.10|
CN1CCN(CC1)C1=c2ccccc2=Nc2ccc(Cl)cc2N1 |c:8,15|
CN(C)CCOC(c1ccccc1)c2ccccc2
c1c[nH]cn1
CN(C)CCN(Cc1ccc(cc1)OC)c2ccccn2
CN\C([CH-][N+]([O-])=O)=[NH+]/CCSCc1ccc(CN(C)C)o1
CNC(NC#N)=NCCSCc1[nH]cnc1C |w:6.6|
[#6]-[#7]-1-[#6]-[#6]\[#6](-[#6]-[#6]-1)=[#6]-1/c2ccccc2-[#6]=[#6]-c2ccccc-12 |c:16|
CN(C)CCCSC(N)=N
C(CCNC1CCCCC1)CCc1cnc[nH]1
CC(C)NCCCCCc1cnc[nH]1
Clc1ccc(CNCCCCCc2cnc[nH]2)cc1
CN(C)CCCCCc1cnc[nH]1
C(CCN1CCCCC1)CCc1cnc[nH]1
CCn1c2nocc2c(=O)[nH]c1=O
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
c1cc(c(c(c1)Cl)Cl)N2CCN(CC2)CCCCOc3ccc4c(c3)NC(=O)CC4
CN(C)[C@@H]1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C#N)C1 |r|
O=C(CCCCC1CCCCC1)N1CCC(CC1)c1cnc[nH]1
CCc1c(nn(c1-c1ccc(Br)cc1)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCC1
C(COc1ccc(CN2CCCCC2)cc1)CN1CCCCC1
C[C@@H]1CC[C@@H](C)N1CCCOc1ccc(cc1)-c1ccc(cc1)C(=O)N1CCOCC1 |r|
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N |r|
CC(C)(C)CCC#C[C@@H]1C[C@H]1c1cnc[nH]1
COc1ccccc1N1CCN(CCN(C(=O)C2CCCCC2)c2ccccn2)CC1
C[C@@H]1CCCN1[C@@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC3)C(=O)OC(C)(C)C)C2=O)c(C)c1 |r|
C[C@@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC3)C(=O)OC(C)(C)C)C2=O)c(C)c1 |r|
C[C@H]1CCCN1[C@@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC3)C(=O)OC(C)(C)C)C2=O)c(C)c1 |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC3)C(=O)OC(C)(C)C)C2=O)c(C)c1 |r|
CC1CCCN1C1CCN(C1)c1ccc(N2CCC3(CCN(CC3)C(=O)OC(C)(C)C)C2=O)c(C)c1
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCNCC3)C2=O)c(C)c1 |r|
C[C@@H]1CCCN1[C@@H]1CCN(C1)c1ccc(N2CCC3(CCNCC3)C2=O)c(C)c1 |r|
C[C@@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCNCC3)C2=O)c(C)c1 |r|
C[C@H]1CCCN1[C@@H]1CCN(C1)c1ccc(N2CCC3(CCNCC3)C2=O)c(C)c1 |r|
C[C@@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC4CCCC4)CC3)C2=O)c(C)c1 |r|
C[C@@H]1CCCN1[C@@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC4CCCC4)CC3)C2=O)c(C)c1 |r|
C[C@H]1CCCN1[C@@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC4CCCC4)CC3)C2=O)c(C)c1 |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC4CCCC4)CC3)C2=O)c(C)c1 |r|
CC1CCCN1C1CCN(C1)c1ccc(N2CCC3(CCN(CC4CCCC4)CC3)C2=O)c(C)c1
C[C@@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC3)C(=O)c3ccc(OC(F)(F)F)cc3)C2=O)c(C)c1 |r|
C[C@@H]1CCCN1[C@@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC3)C(=O)c3ccc(OC(F)(F)F)cc3)C2=O)c(C)c1 |r|
C[C@H]1CCCN1[C@@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC3)C(=O)c3ccc(OC(F)(F)F)cc3)C2=O)c(C)c1 |r|
CC1CCCN1C1CCN(C1)c1ccc(N2CCC3(CCN(CC3)C(=O)c3ccc(OC(F)(F)F)cc3)C2=O)c(C)c1
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC3)C(=O)c3ccc(OC(F)(F)F)cc3)C2=O)c(C)c1 |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCCC3(CCN(CC3)C(=O)OC(C)(C)C)C2=O)c(C)c1 |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(cc1)N1CCCC2(CCN(CC2)C(=O)OC(C)(C)C)C1=O |r|
CC(C)(C)OC(=O)N1CCC2(CCCN(C2=O)c2ccc(cc2F)N2CC[C@@H](C2)N2CCCC2)CC1 |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCCC3(CCNCC3)C2=O)c(C)c1 |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(cc1)N1CCCC2(CCNCC2)C1=O |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCCC3(CCNCC3)C2=O)c(F)c1 |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCCC3(CCN(CC3)C(=O)c3ccncc3)C2=O)c(C)c1 |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCCC3(CCN(CC3)C(=O)c3ccoc3)C2=O)c(C)c1 |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(cc1)N1CCCC2(CCN(CC2)C(=O)c2ccccc2)C1=O |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(cc1)N1CCCC2(CCN(CC2)C(=O)c2ccc(F)cc2)C1=O |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCCC3(CCN(CC3)C(=O)C3CCCCC3)C2=O)c(F)c1 |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCCC3(CCN(CC3)C(=O)C3CCOCC3)C2=O)c(F)c1 |r|
CC(C)N1CCC2(CCCN(C2=O)c2ccc(cc2C)N2CC[C@@H](C2)N2CCC[C@@H]2C)CC1 |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCCC3(CCN(CC4CCCCC4)CC3)C2=O)c(C)c1 |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(cc1)N1CCCC2(CCN(CC3CC3)CC2)C1=O |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(cc1)N1CCCC2(CCN(CC2)C2CCOCC2)C1=O |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCCC3(CCN(Cc4ccccc4)CC3)C2=O)c(F)c1 |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCCC3(CCN(Cc4ccco4)CC3)C2=O)c(F)c1 |r|
C[C@H]1CCCN1C1CCN(CC1)c1ccc(cc1)N1CCC2(CCN(CC2)C(=O)OC(C)(C)C)C1=O |r|
C[C@H]1CCCN1C1CCN(CC1)c1ccc(N2CCC3(CCN(CC3)C(=O)OC(C)(C)C)C2=O)c(c1)C(F)(F)F |r|
C[C@H]1CCCN1C1CCN(CC1)c1ccc(N2CCC3(CCN(CC3)C(=O)OC(C)(C)C)C2=O)c(F)c1 |r|
C[C@H]1CCCCN1[C@H]1CCN(C1)c1ccc(cc1)N1CCC2(CCN(CC2)C(=O)OC(C)(C)C)C1=O |r|
C[C@H]1CCCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC3)C(=O)OC(C)(C)C)C2=O)c(c1)C(F)(F)F |r|
C[C@H]1CCCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC3)C(=O)OC(C)(C)C)C2=O)c(F)c1 |r|
C[C@H]1CCCN1C1CCN(CC1)c1ccc(cc1)N1CCC2(CCNCC2)C1=O |r|
C[C@H]1CCCN1C1CCN(CC1)c1ccc(N2CCC3(CCNCC3)C2=O)c(c1)C(F)(F)F |r|
C[C@H]1CCCN1C1CCN(CC1)c1ccc(N2CCC3(CCNCC3)C2=O)c(F)c1 |r|
C[C@H]1CCCCN1[C@H]1CCN(C1)c1ccc(cc1)N1CCC2(CCNCC2)C1=O |r|
C[C@H]1CCCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCNCC3)C2=O)c(c1)C(F)(F)F |r|
C[C@H]1CCCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCNCC3)C2=O)c(F)c1 |r|
C[C@H]1CCCN1C1CCN(CC1)c1ccc(cc1)N1CCC2(CCN(CC2)S(=O)(=O)c2ccccc2)C1=O |r|
C[C@H]1CCCN1C1CCN(CC1)c1ccc(cc1)N1CCC2(CCN(CC2)C(=O)c2ccc(F)cc2)C1=O |r|
C[C@H]1CCCN1C1CCN(CC1)c1ccc(N2CCC3(CCN(CC3)C(=O)C3CCCCC3)C2=O)c(F)c1 |r|
C[C@H]1CCCCN1[C@H]1CCN(C1)c1ccc(cc1)N1CCC2(CCN(CC2)S(=O)(=O)c2ccc(F)cc2)C1=O |r|
C[C@H]1CCCCN1[C@H]1CCN(C1)c1ccc(cc1)N1CCC2(CCN(CC2)C(=O)C2CCOCC2)C1=O |r|
C[C@H]1CCCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC3)C(=O)C3CCCC3)C2=O)c(c1)C(F)(F)F |r|
C[C@H]1CCCN1C1CCN(CC1)c1ccc(N2CCC3(CCN(CC4CC4)CC3)C2=O)c(F)c1 |r|
C[C@H]1CCCN1C1CCN(CC1)c1ccc(N2CCC3(CCN(CC4CCCC4)CC3)C2=O)c(F)c1 |r|
C[C@H]1CCCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC4CCCCC4)CC3)C2=O)c(c1)C(F)(F)F |r|
C[C@H]1CCCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC4CCOCC4)CC3)C2=O)c(F)c1 |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC3)C(=O)Cc3ccccc3)C2=O)c(c1)C(F)(F)F |r|
COCC(=O)N1CCC2(CCN(C2=O)c2ccc(cc2C(F)(F)F)N2CC[C@@H](C2)N2CCC[C@@H]2C)CC1 |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC3)C(=O)c3ccc4ccccc4c3)C2=O)c(c1)C(F)(F)F |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC3)C(=O)c3ccccc3)C2=O)c(c1)C(F)(F)F |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC3)C(=O)c3ccoc3)C2=O)c(c1)C(F)(F)F |r|
COc1ccc(cc1)S(=O)(=O)N1CCC2(CCN(C2=O)c2ccc(cc2C(F)(F)F)N2CC[C@@H](C2)N2CCC[C@@H]2C)CC1 |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCN(Cc4ccco4)CC3)C2=O)c(c1)C(F)(F)F |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC4CC4)CC3)C2=O)c(c1)C(F)(F)F |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCN(CC4CCOCC4)CC3)C2=O)c(c1)C(F)(F)F |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(N2CCC3(CCNCC3)C2=O)c(c1)C(F)(F)F |r|
C(N1CCCC1)c1ccc2nc(sc2c1)N1CCN(CC1)C1CC1
C(NC1CC1)c1ccc2nc(sc2c1)N1CCN(CC1)C1CC1
CN(C)CCNc1ccnc(N)n1
CN(C)CCN(C)c1ccnc(N)n1
CC(N)CNc1ccnc(N)n1
CC(C)(N)CNc1ccnc(N)n1
NCCCNc1ccnc(N)n1
CNCCCNc1ccnc(N)n1
CN(CCCN)c1ccnc(N)n1
CCC(N)CCNc1ccnc(N)n1
CC(C)(CN)CNc1ccnc(N)n1
Nc1nccc(NC2CCN(Cc3ccccc3)CC2)n1
CN1CCN(CC1)c1ccnc(N)n1
CC(C)(C)OC(=O)N1CCN(CC1)c1ccnc(N)n1
CC(C)(C)OC(=O)N1CCC(CNc2ccnc(N)n2)CC1
NC1CCC(CC1)Nc1ccnc(N)n1 |(-4.17,1.9,;-2.83,1.13,;-2.83,-.41,;-1.5,-1.18,;-.17,-.41,;-.17,1.13,;-1.5,1.9,;1.17,-1.18,;2.5,-.41,;3.84,-1.18,;5.17,-.41,;5.17,1.13,;3.84,1.9,;3.84,3.44,;2.5,1.13,)|
CC(C)(C)OC(=O)N1CC[C@H](C1)Nc1ccnc(N)n1
Nc1nccc(N[C@@H]2CCNC2)n1
Nc1nccc(n1)N1C[C@@H]2CN(Cc3ccccc3)C[C@@H]2C1
NC1CCN(CC1)c1ccnc(N)n1
Nc1nccc(n1)N1CCCN(Cc2ccccc2)CCC1
Nc1nccc(NC2CNC2)n1
Nc1nccc(n1)N1CCC2(CNC2)CC1
Nc1nccc(NC2CCNCC2)n1
Nc1nccc(n1)N1CCNCC1
CC(C)N1CCN(CC1)C(=O)[C@H]1CC1c1ccccc1 |r|
O=C([C@H]1CC1c1ccccc1)N1CCN(CC1)C1CCCCC1 |r|
O=C([C@H]1CC1c1ccccc1)N1CCN(CC1)C1CCCCCC1 |r|
O=C([C@H]1CC1c1ccccc1)N1CCN(CC1)C1CCC1 |r|
O=C([C@H]1CC1c1ccccc1)N1CCN(CC1)C1CC1 |r|
O=C([C@H]1CC1c1ccccc1)N1CCN(CC1)C1CCCC1 |r|
CCCN1CCN(CC1)C(=O)[C@H]1CC1c1ccccc1 |r|
O=C([C@H]1CC1c1ccccc1)N1CCCN(CC1)C1CCC1 |r|
CC(C)(C)N1CCN(CC1)C(=O)[C@H]1CC1c1ccccc1 |r|
CC(C)N1CCN(CC1)C(=O)[C@H]1CC1c1ccc(F)cc1 |r|
Brc1ccc(cc1)C1C[C@@H]1C(=O)N1CCN(CC1)C1CCC1 |r|
Brc1ccc(cc1)C1C[C@H]1C(=O)N1CCN(CC1)C1CCC1 |r|
CN1CCN(C1=O)c1ccc(cc1)C1C[C@@H]1C(=O)N1CCN(CC1)C1CCC1 |r|
O=C([C@H]1CC1c1ccc(cc1)N1CCCC1=O)N1CCN(CC1)C1CCC1 |r|
CS(=O)(=O)Nc1ccc(cc1)C1C[C@@H]1C(=O)N1CCN(CC1)C1CCC1 |r|
O=C([C@H]1CC1c1ccc(cc1)N1CCCC1)N1CCN(CC1)C1CCC1 |r|
O=C([C@H]1CC1c1ccc(cc1)-c1cn[nH]c1)N1CCN(CC1)C1CCC1 |r|
O=C([C@H]1CC1c1ccc(cc1)C#N)N1CCN(CC1)C1CCC1 |r|
O=C([C@@H]1CC1c1ccccc1)N1CCN(CC1)C1CCC1 |r|
FC(F)(F)c1ccc(cn1)C1C[C@@H]1C(=O)N1CCN(CC1)C1CCC1 |r|
Fc1ccc(cc1)C1CC1C(=O)N1CCN(CC1)C1CCC1
Brc1cccc(c1)C1CC1C(=O)N1CCN(CC1)C1CCC1
O=C(C1CC1c1cccc(c1)C#N)N1CCN(CC1)C1CCC1
CC(C)N1CCN(CC1)C(=O)C1CC1c1ccccc1
O=C([C@H]1CC1c1cccc(c1)N1CCCC1=O)N1CCN(CC1)C1CCC1 |r|
NC(=O)c1ccc(cc1)C1CC1C(=O)N1CCN(CC1)C1CCC1
CS(=O)(=O)Nc1cccc(c1)C1CC1C(=O)N1CCN(CC1)C1CCC1
NC(=O)c1cccc(c1)C1CC1C(=O)N1CCN(CC1)C1CCC1
O=C(C1CC1c1cccc(c1)N1CCCC1=O)N1CCN(CC1)C1CCC1
O=C(C1CC1c1cccc(c1)N1CCCCC1=O)N1CCN(CC1)C1CCC1
CC(C)N1CCN(CC1)C(=O)C1CC1c1cnn(C)c1
O=C([C@H]1CC1c1ccc(cc1)-c1cncnc1)N1CCN(CC1)C1CCC1 |r|
O=C(OC1CCN(CC1)c1ccc(=O)[nH]n1)N1CCN(CC1)C1CCC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(=O)n(C)n1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(=O)[nH]n1
O=C(OC1CCN(CC1)c1ccc(=O)[nH]n1)N1CCN(CC1)C1CC1
Cn1nc(ccc1=O)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
CCn1nc(ccc1=O)N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccn(C)c(=O)c1
O=C(OC1CCN(CC1)c1cc[nH]c(=O)c1)N1CCN(CC1)C1CCC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1cc[nH]c(=O)c1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(=O)[nH]c1
CC1=C(SC2=NCc3ccccc3CN12)c1ccc(OCCCN2CCC[C@H]2CO)cc1 |r,t:1,4|
CC1=C(SC2=NCc3ccccc3CN12)c1ccc(OCCCN2CCCCC2)cc1 |t:1,4|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C1=C(C)N2Cc3ccccc3CN=C2S1 |r,c:18,31|
CC1=C(SC2=NCc3ccccc3CN12)c1ccc(OCCCN2CCOCC2)cc1 |t:1,4|
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(cn1)C(N)=O
NC(=O)c1ccc(nc1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
NC(=O)c1ccc(nc1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCCC1
NC(=O)c1ccc(nc1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(cn1)C(=O)N(C)C
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(cn1)[N+]#[C-]
CNC(=O)c1ccc(nc1)N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccccn1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(F)cn1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(cn1)C(F)(F)F
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(C)cn1
COC(=O)c1ccc(nc1)N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
CC(C)OC(=O)c1ccc(nc1)N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
CCOC(=O)c1ccc(nc1)N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1cnc(cn1)C(N)=O
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(cn1)C(C)=O
CC(C)N1CCCN(CC1)C(=O)OC1CCN(CC1)c1ccc(cn1)C(N)=O
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(CO)cn1
O=C(OC1CCN(CC1)c1ccccn1)N1CCN(CC1)C1CCC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ncccc1F
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ncccc1C(F)(F)F
FC(F)(F)c1cccnc1N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
COC(=O)c1cccnc1N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1cc(F)ccn1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1cc(ccn1)C#N
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1cc(ccn1)C(F)(F)F
COC(=O)c1ccnc(c1)N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
COC(=O)c1ccnc(c1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
COc1ccnc(c1)N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
COCc1ccnc(c1)N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1cc(CO)ccn1
Fc1ccc(nc1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
COC(=O)c1ccc(nc1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
COc1ccc(nc1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CC1
CCN1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(OC)cn1
COc1ccc(nc1)N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
COc1ccc(nc1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(cn1)C(O)=O
CC(=O)c1ccc(nc1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(cn1)C(=O)NC1CCC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(cn1)C(C)(C)O
O=C(OC1CCN(CC1)c1ccc(cn1)N1CCCC1=O)N1CCN(CC1)C1CCC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(cn1)N1CCCC1=O
CC(CO)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(cn1)C(N)=O
COCC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(cn1)C(N)=O
NC(=O)c1ccc(nc1)N1CCC(CC1)OC(=O)N1CCN(CCO)CC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(cn1)-c1nccs1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1cccc(n1)C(F)(F)F
O=C(OC1CCN(CC1)c1cccc(n1)[N+]#[C-])N1CCN(CC1)C1CCC1
COC(=O)c1cccc(n1)N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
COC(=O)c1cccc(n1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
COCc1cccc(n1)N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
COCc1cccc(n1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1cccc(CO)n1
COc1cccc(n1)N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1cccc(n1)[N+]#[C-]
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(nc1)C(N)=O
COC(=O)c1ccc(cn1)N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
COC(=O)c1ccc(cn1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccc(CO)nc1
OCc1ccc(cn1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
COCc1ccc(cn1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
COCc1ccc(cn1)N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
NC(=O)c1ccc(cn1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccncc1
O=C(OC1CCN(CC1)c1ccncc1)N1CCN(CC1)C1CCC1
COc1ccc(nn1)N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
COc1ccc(nn1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
COc1cncc(n1)N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
COc1cncc(n1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccn2ccnc2c1
O=C(OC1CCN(CC1)c1ccn2ccnc2c1)N1CCN(CC1)C1CCC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ccn2cc(C)nc2c1
NC(=O)c1ccc(cc1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1cscn1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1cncs1
O=C(OC1CCN(CC1)c1cncs1)N1CCN(CC1)C1CCC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1nccs1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ncc(C)s1
COC(=O)c1cnc(s1)N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
COC(=O)c1cnc(s1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ncc(s1)C(N)=O
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1ncc(CO)s1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1nc(C)cs1
Cc1csc(n1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
COC(=O)c1csc(n1)N1CCC(CC1)OC(=O)N1CCN(CC1)C(C)C
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1nc(CO)cs1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1nc(cs1)C(N)=O
COC(=O)c1csc(n1)N1CCC(CC1)OC(=O)N1CCN(CC1)C1CCC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1nncs1
O=C(OC1CCN(CC1)c1nncs1)N1CCN(CC1)C1CCC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1nnc(C)s1
O=C(OC1CCN(CC1)c1nnc(s1)N1CCOCC1)N1CCN(CC1)C1CCC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(CC1)c1nnc(s1)N1CCOCC1
CC(C)N1CCN(CC1)C(=O)OC1CCN(C1)c1ccc(cn1)C(N)=O
CC(C)N1CCN(CC1)C(=O)OC1CCN(C1)c1ccc(cn1)C(F)(F)F
CC(C)N1CCN(CC1)C(=O)OC1CCN(C1)c1ccc(cn1)[N+]#[C-]
CC(C)N1CCN(CC1)C(=O)OC1CCN(C1)c1ccc(nc1)C(N)=O
CC(C)N1CCN(CC1)C(=O)OC1CN(C1)c1ccc(cn1)C(N)=O
CC(C)N1CCN(CC1)C(=O)OC1CN(C1)c1ccc(cn1)[N+]#[C-]
CC(C)N1CCN(CC1)C(=O)OC1CN(C1)c1ccc(cn1)C(F)(F)F
CC(C)N1CCN(CC1)C(=O)NC1CCN(CC1)c1ccc(cn1)C(N)=O
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(cc1)C(O)=O |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(CC(O)=O)cc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(CCC(O)=O)cc1 |r|
CCOC(=O)COCc1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(COCC(O)=O)cc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(CCn2cnnn2)cc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(CCn2ncnn2)cc1 |r|
COC(=O)CCc1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(cc1)C(C)(C)C(O)=O |r|
CCOC(=O)CCc1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(CCC(=O)NC(C)(C)C(=O)OC(C)(C)C)cc1 |r|
C[C@H](NC(=O)CCc1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1)C(=O)OC(C)(C)C |r|
COC(=O)CCCNC(=O)C1(CCCC1)c1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
C[C@H](NC(=O)CCc1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1)C(O)=O |r|
CCOC(=O)[C@H]1CCCC[C@H]1NC(=O)C1(CCCC1)c1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
COC(=O)CNC(=O)CCc1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
COC(=O)C1(CCCC1)c1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(CCC(=O)NCC(=O)OC(C)(C)C)cc1 |r|
COC(=O)CNC(=O)C1(CCCC1)c1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(cc1)C1(CCCC1)C(=O)NCCCC(O)=O |r|
CCOC(=O)C1CCN(CC1)C(=O)CCc1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(Cc2nnn[nH]2)cc1 |r|
COC(=O)C(C)(C)NC(=O)c1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(cc1)C(=O)NCCC(O)=O |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(CCc2nnn[nH]2)cc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(CCCC(O)=O)cc1 |r|
CN1CCN(CC1)c1nc2cc(C)cnc2n2cnnc12
CN1CCN(CC1)c1nc2ncc(C)cc2n2cnnc12
CN1CCN(CC1)c1nc2ncccc2n2cnnc12
CN1CCN(CC1)c1nc2ncc(Cl)cc2n2cnnc12
CN1CCN(CC1)c1nc2cc(Cl)cnc2n2cnnc12
CN1CCN(CC1)c1nc2cccnc2n2cnnc12
Clc1cnc2nc(N3CCNCC3)c3nncn3c2c1
NC1CN(C1)c1nc2ncc(Cl)cc2n2cnnc12
CN(C)[C@@H]1CCN(C1)c1nc2ncc(Cl)cc2n2cnnc12 |r|
CN[C@@H]1CCN(C1)c1nc2ncc(Cl)cc2n2cnnc12 |r|
CN[C@@H]1CCN(C1)c1nc2cc(Cl)cnc2n2cnnc12 |r|
CN1CCN(CC1)c1nc2ncc(cc2n2cnnc12)[N+]#[C-]
CN1CCN(CC1)c1nc2ncc(Cl)cc2n2c(C)nnc12
Cc1nnc2c(nc3ncc(Cl)cc3n12)N1CCNCC1
Brc1cnc2nc(N3CCNCC3)c3nncn3c2c1
CN1CCN(CC1)c1nc2nc(Cl)c(Cl)cc2n2cnnc12
CNC1CN(C1)c1nc2ncc(Cl)cc2n2cnnc12
C[C@H]1CN(CCN1)c1nc2ncc(Cl)cc2n2cnnc12 |r|
C[C@H]1CN(CCN1C)c1nc2ncc(Cl)cc2n2cnnc12 |r|
CC1CN(CC(C)N1C)c1nc2ncc(Cl)cc2n2cnnc12
CCOc1nc2nc(N3CCN(C)CC3)c3nncn3c2cc1Cl
CNC1CN(C1)c1nc2ncc(Br)cc2n2cnnc12
CNC1CN(C1)c1nc2ncc(cc2n2cnnc12)[N+]#[C-]
[C-]#[N+]c1cnc2nc(N3CCNCC3)c3nncn3c2c1
CNC1CN(C1)c1nc2nc(Cl)c(Cl)cc2n2cnnc12
CNC1CN(C1)c1nc2nc([N+]#[C-])c(Cl)cc2n2cnnc12
N[C@@H]1CCN(C1)c1nc2ncc(Cl)cc2n2cnnc12 |r|
CN1CCN(CC1)c1nc2ncc(Cl)cc2c2nc(C)nn12
Cc1nc2c3cc(Cl)cnc3nc(N3CCNCC3)n2n1
CNC1CN(C1)c1nc2ncc(Cl)cc2c2nc(C)nn12
CNC1CN(C1)c1nc2ncc(Cl)cc2c2ncnn12
Clc1cnc2nc(N3CCNCC3)n3ncnc3c2c1
CN1CCN(CC1)c1nc2ncc(Cl)cc2c2nc(nn12)C1CC1
Clc1cnc2nc(N3CCNCC3)n3nc(nc3c2c1)C1CC1
COCc1nc2c3cc(Cl)cnc3nc(N3CCN(C)CC3)n2n1
CCc1nc2c3cc(Cl)cnc3nc(N3CCN(C)CC3)n2n1
CN1CCN(CC1)c1nc2ncc(Cl)cc2c2cn(C)nc12
CNC1CN(C1)c1nc2ncc(Cl)cc2c2cn(C)nc12
Cn1cc2c(n1)c(nc1ncc(Cl)cc21)N1CCNCC1
CNC1CN(C1)c1nc2ncc(I)cc2n2cnnc12
CN1CCN(CC1)c1nc2ncc(I)cc2n2cnnc12
CNC1CN(C1)c1nc2ncc(C)cc2n2cnnc12
CNC1CN(C1)c1nc2ncc(cc2n2cnnc12)C(F)F
NC1CN(C1)c1nc2ncc(cc2n2cnnc12)C(F)(F)F
CNC1CN(C1)c1nc2ncc(cc2n2cnnc12)C#C
CNC1CN(C1)c1nc2ncc(C=C)cc2n2cnnc12
CCc1cnc2nc(N3CC(C3)NC)c3nncn3c2c1
CNC1CN(C1)c1nc2ncc(O)cc2n2cnnc12
CNC1CN(C1)c1nc2ncc(OC)cc2n2cnnc12
CNC1CN(C1)c1nc2ncc(OC(F)F)cc2n2cnnc12
COc1nc2nc(N3CCN(C)CC3)c3nncn3c2cc1Cl
COc1nc2nc(N3CCNCC3)c3nncn3c2cc1Cl
Clc1cc2c(nc1Cl)nc(N1CCNCC1)c1nncn21
CCOc1nc2nc(N3CCNCC3)c3nncn3c2cc1Cl
CN1CCN(CC1)c1nc2nc(OCC(F)(F)F)c(Cl)cc2n2cnnc12
CNC1CN(C1)c1nc2ncc(Br)c(C)c2n2cnnc12
CNC1CN(C1)c1nc2ncc(Cl)c(Cl)c2n2cnnc12
CNC1CN(C1)c1nc2ncc(Br)cc2n2nnnc12
CN1CC2CN(CC2C1)c1nc2ncc(Cl)cc2n2cnnc12
CN1CC2CN(CC2C1)c1nc2ncc(Br)cc2n2cnnc12
CC1(N)CN(C1)c1nc2ncc(Br)cc2n2cnnc12
CNC1(C)CN(C1)c1nc2ncc(Br)cc2n2cnnc12
Clc1cnc2nc(N3CCN(CC3)C3CC3)c3nncn3c2c1
Clc1cnc2nc(N3C[C@@H]4C[C@H]3CN4)c3nncn3c2c1 |r|
CN1C[C@@H]2C[C@H]1CN2c1nc2ncc(Cl)cc2n2cnnc12 |r|
Clc1cnc2nc(N3CCCNCC3)c3nncn3c2c1
CN[C@@H]1CCN(C1)c1nc2ncc(Br)cc2n2cnnc12 |r|
Clc1cnc2nc(N3CC4CCCNC4C3)c3nncn3c2c1
CN1CCCC2CN(CC12)c1nc2ncc(Cl)cc2n2cnnc12
CN(C)C1CN(C1)c1nc2ncc(Cl)cc2n2cnnc12
CN(C)C1CN(C1)c1nc2ncc(Br)cc2n2cnnc12
OCCNc1nc2ncc(Cl)cc2n2cnnc12
CNC1CN(C1)c1nc2ncc(Cl)cc2n2ccnc12
CNC1CN(C1)c1nc2ncc(Br)cc2n2ccnc12
CN(C1CN(C1)c1nc2ncc(Cl)cc2c2oc(C)nc12)C(=O)OC(C)(C)C
CNC1CN(C1)c1nc2ncc(Cl)cc2c2oc(C)nc12
CN1CCN(CC1)C1=Nc2ncc(Cl)cc2C2OC(C)=NC12 |c:21,t:8|
CNC1CN(C1)c1nc2ncc(Cl)cc2n2nnnc12
CNC1CN(C1)c1nc2ncc(Cl)cc2n2nc(C)nc12
CNC1CN(C1)c1nc2nc(C)c(Br)cc2n2cnnc12
CN1CCN(CC1)c1nc2nc(C)c(Br)cc2n2cnnc12
CNC1CN(C1)c1nc2nc(O)c(Cl)cc2n2cnnc12
CN(O)C1CN(C1)c1nc2ncc(Br)cc2n2cnnc12
CNC1CN(C1)C1=Nc2ncc(Br)cc2N2C[C@H](C)N=C12 |r,t:7,21|
CNC1CN(C1)C1=Nc2ncc(Br)cc2N2C[C@@H](C)N=C12 |r,t:7,21|
CNC1CN(C1)C1=Nc2ncc(Br)cc2N2CCN=C12 |t:7,20|
CNC1CN(C1)c1nc2ncc(Br)cc2n2cc(C)nc12
CNC1CN(C1)c1nc2ncc(Br)cc2c2cc(C)nn12
CNC1CN(C1)c1nc2ncc(Br)cc2c2ccnn12
CNC1CN(C1)c1nc2ncc(cc2n2cnnc12)[N+]([O-])=O
CNC1CN(C1)c1nc2ncc(N)cc2n2cnnc12
CNC1CN(C1)c1nc2ncc(cc2n2cnnc12)-c1ccccc1
CNC1CN(C1)c1nc2ncc(cc2n2cnnc12)-c1ccco1
CNC1CN(C1)c1nc2ncc(Br)cc2n2cccc12
CNC1CN(C1)c1nc2ccc(Cl)nc2n2cnnc12
CNC1CN(C1)c1nc2cnc(Cl)cc2n2cnnc12
CN1CCN(CC1)c1nc2ccc(Cl)cc2n2cnnc12
CC(C)(C)OC(=O)N1CCC(CC1)Oc1ccc(OCCCN2CCCCC2)cc1
C(COc1ccc(OC2CCNCC2)cc1)CN1CCCCC1
CC(=O)N1CCC(CC1)Oc1ccc(OCCCN2CCCCC2)cc1
O=C(C1CCC1)N1CCC(CC1)Oc1ccc(OCCCN2CCCCC2)cc1
CC1(CC1)C(=O)N1CCC(CC1)Oc1ccc(OCCCN2CCCCC2)cc1
CCOC(=O)N1CCC(CC1)Oc1ccc(OCCCN2CCCCC2)cc1
CCNC(=O)N1CCC(CC1)Oc1ccc(OCCCN2CCCCC2)cc1
CCN(C)C(=O)N1CCC(CC1)Oc1ccc(OCCCN2CCCCC2)cc1
C[C@@H]1CCCN1CCCOc1ccc(OC2CCN(CC2)C(=O)OC(C)(C)C)cc1 |r|
C[C@@H]1CCCN1CCCOc1ccc(OC2CCNCC2)cc1 |r|
C[C@@H]1CCCN1CCCOc1ccc(OC2CCN(CC2)C(C)=O)cc1 |r|
C[C@@H]1CCCN1CCCOc1ccc(OC2CCN(CC2)C(=O)C2CCC2)cc1 |r|
C[C@@H]1CCCN1CCCOc1ccc(OC2CCN(CC2)C(=O)C2(C)CC2)cc1 |r|
CCOC(=O)N1CCC(CC1)Oc1ccc(OCCCN2CCC[C@H]2C)cc1 |r|
CCNC(=O)N1CCC(CC1)Oc1ccc(OCCCN2CCC[C@H]2C)cc1 |r|
CCN(C)C(=O)N1CCC(CC1)Oc1ccc(OCCCN2CCC[C@H]2C)cc1 |r|
Cc1nc2ccc(cc2c(=O)n1-c1ccc(OCCCN2CCCC2)cc1)S(F)(F)(F)(F)F
C[C@H]1CCCN1CCCOc1ccc(cc1)-n1c(C)nc2ccc(cc2c1=O)S(F)(F)(F)(F)F |r|
Cc1nc2ccc(cc2c(=O)n1-c1ccc(OCCCN2CCCCCC2)cc1)S(F)(F)(F)(F)F
C[C@@H]1CCCN1CCCOc1ccc(cc1)-n1c(C)nc2ccc(cc2c1=O)S(F)(F)(F)(F)F |r|
C[C@H]1CCCN(CCCOc2ccc(cc2)-n2c(C)nc3ccc(cc3c2=O)S(F)(F)(F)(F)F)C1 |r|
COc1cc(OCCCN2CCC[C@H](C)C2)ccc1-n1c(C)nc2ccc(cc2c1=O)S(F)(F)(F)(F)F |r,wU:13.13,(.78,-31.19,;-.55,-30.42,;-.55,-28.88,;.78,-28.11,;.78,-26.57,;2.12,-25.8,;3.45,-26.57,;4.78,-25.8,;6.12,-26.57,;7.45,-25.8,;8.78,-26.57,;10.12,-25.8,;10.12,-24.26,;8.78,-23.49,;8.78,-21.95,;7.45,-24.26,;-.55,-25.8,;-1.89,-26.57,;-1.89,-28.11,;-3.22,-28.88,;-3.22,-30.42,;-1.89,-31.19,;-4.55,-31.19,;-5.89,-30.42,;-7.22,-31.19,;-8.55,-30.42,;-8.55,-28.88,;-7.22,-28.11,;-5.89,-28.88,;-4.55,-28.11,;-4.55,-26.57,;-9.89,-28.11,;-11.22,-28.88,;-9.89,-26.57,;-9.89,-29.65,;-8.55,-27.34,;-11.22,-27.34,)|
CC1CCN(CCCOc2ccc(cc2)-n2c(C)nc3ccc(cc3c2=O)S(F)(F)(F)(F)F)C1
Cc1nc2ccc(cc2c(=O)n1-c1ccc(OCCCN2CCCC2)cc1O)S(F)(F)(F)(F)F |(-1.89,-31.19,;-3.22,-30.42,;-4.55,-31.19,;-5.89,-30.42,;-7.22,-31.19,;-8.55,-30.42,;-8.55,-28.88,;-7.22,-28.11,;-5.89,-28.88,;-4.55,-28.11,;-4.55,-26.57,;-3.22,-28.88,;-1.89,-28.11,;-1.89,-26.57,;-.55,-25.8,;.78,-26.57,;2.12,-25.8,;3.45,-26.57,;4.78,-25.8,;6.12,-26.57,;7.45,-25.8,;8.86,-26.43,;9.89,-25.28,;9.12,-23.95,;7.61,-24.27,;.78,-28.11,;-.55,-28.88,;-.55,-30.42,;-9.89,-28.11,;-11.22,-28.88,;-9.89,-26.57,;-9.89,-29.65,;-8.55,-27.34,;-11.22,-27.34,)|
COc1cc(OCCCN2CCC[C@H]2C)ccc1-n1c(C)nc2ccc(cc2c1=O)S(F)(F)(F)(F)F |r,wD:13.14,(.78,-31.19,;-.55,-30.42,;-.55,-28.88,;.78,-28.11,;.78,-26.57,;2.12,-25.8,;3.45,-26.57,;4.78,-25.8,;6.12,-26.57,;7.45,-25.8,;8.86,-26.43,;9.89,-25.28,;9.12,-23.95,;7.61,-24.27,;6.47,-23.24,;-.55,-25.8,;-1.89,-26.57,;-1.89,-28.11,;-3.22,-28.88,;-3.22,-30.42,;-1.89,-31.19,;-4.55,-31.19,;-5.89,-30.42,;-7.22,-31.19,;-8.55,-30.42,;-8.55,-28.88,;-7.22,-28.11,;-5.89,-28.88,;-4.55,-28.11,;-4.55,-26.57,;-9.89,-28.11,;-11.22,-28.88,;-9.89,-26.57,;-9.89,-29.65,;-8.55,-27.34,;-11.22,-27.34,)|
COc1cc(OCCCN2CCC(C)C2)ccc1-n1c(C)nc2ccc(cc2c1=O)S(F)(F)(F)(F)F |(.78,-31.19,;-.55,-30.42,;-.55,-28.88,;.78,-28.11,;.78,-26.57,;2.12,-25.8,;3.45,-26.57,;4.78,-25.8,;6.12,-26.57,;7.45,-25.8,;8.86,-26.43,;9.89,-25.28,;9.12,-23.95,;9.74,-22.54,;7.61,-24.27,;-.55,-25.8,;-1.89,-26.57,;-1.89,-28.11,;-3.22,-28.88,;-3.22,-30.42,;-1.89,-31.19,;-4.55,-31.19,;-5.89,-30.42,;-7.22,-31.19,;-8.55,-30.42,;-8.55,-28.88,;-7.22,-28.11,;-5.89,-28.88,;-4.55,-28.11,;-4.55,-26.57,;-9.89,-28.11,;-11.22,-28.88,;-9.89,-26.57,;-9.89,-29.65,;-8.55,-27.34,;-11.22,-27.34,)|
COc1cc(OCCCN2CCC[C@@H]2C)ccc1-n1c(C)nc2ccc(cc2c1=O)S(F)(F)(F)(F)F |r,wU:13.14,(.78,-31.19,;-.55,-30.42,;-.55,-28.88,;.78,-28.11,;.78,-26.57,;2.12,-25.8,;3.45,-26.57,;4.78,-25.8,;6.12,-26.57,;7.45,-25.8,;8.86,-26.43,;9.89,-25.28,;9.12,-23.95,;7.61,-24.27,;6.47,-23.24,;-.55,-25.8,;-1.89,-26.57,;-1.89,-28.11,;-3.22,-28.88,;-3.22,-30.42,;-1.89,-31.19,;-4.55,-31.19,;-5.89,-30.42,;-7.22,-31.19,;-8.55,-30.42,;-8.55,-28.88,;-7.22,-28.11,;-5.89,-28.88,;-4.55,-28.11,;-4.55,-26.57,;-9.89,-28.11,;-11.22,-28.88,;-9.89,-26.57,;-9.89,-29.65,;-8.55,-27.34,;-11.22,-27.34,)|
Cc1nc2ccc(cc2c(=O)n1-c1ccc(OC2CCC(CC2)C2CC2)cc1)S(F)(F)(F)(F)F |(-1.89,-31.19,;-3.22,-30.42,;-4.55,-31.19,;-5.89,-30.42,;-7.22,-31.19,;-8.55,-30.42,;-8.55,-28.88,;-7.22,-28.11,;-5.89,-28.88,;-4.55,-28.11,;-4.55,-26.57,;-3.22,-28.88,;-1.89,-28.11,;-.55,-28.88,;.78,-28.11,;.78,-26.57,;2.12,-25.8,;3.45,-26.57,;3.45,-28.11,;4.78,-28.88,;6.12,-28.11,;6.12,-26.57,;4.78,-25.8,;7.45,-28.88,;7.93,-30.35,;8.98,-29.04,;-.55,-25.8,;-1.89,-26.57,;-9.89,-28.11,;-11.22,-28.88,;-9.89,-26.57,;-9.89,-29.65,;-8.55,-27.34,;-11.22,-27.34,)|
Cc1nc2ccc(cc2c(=O)n1-c1ccc(OC2CCC(CC2)C2CCCC2)cc1)S(F)(F)(F)(F)F |(-1.89,-31.19,;-3.22,-30.42,;-4.55,-31.19,;-5.89,-30.42,;-7.22,-31.19,;-8.55,-30.42,;-8.55,-28.88,;-7.22,-28.11,;-5.89,-28.88,;-4.55,-28.11,;-4.55,-26.57,;-3.22,-28.88,;-1.89,-28.11,;-.55,-28.88,;.78,-28.11,;.78,-26.57,;2.12,-25.8,;3.45,-26.57,;3.45,-28.11,;4.78,-28.88,;6.12,-28.11,;6.12,-26.57,;4.78,-25.8,;7.45,-28.88,;7.61,-30.41,;9.12,-30.73,;9.89,-29.4,;8.86,-28.25,;-.55,-25.8,;-1.89,-26.57,;-9.89,-28.11,;-11.22,-28.88,;-9.89,-26.57,;-9.89,-29.65,;-8.55,-27.34,;-11.22,-27.34,)|
Cc1nc2ccc(cc2c(=O)n1-c1ccc(OC2CCN(CC2)C(=O)C2CCCCC2)cc1)S(F)(F)(F)(F)F
CN1CCC(CC1)C(=O)N1CCC(CC1)Oc1ccc(cc1)-n1c(C)nc2ccc(cc2c1=O)S(F)(F)(F)(F)F
Cc1nc2ccc(cc2c(=O)n1-c1ccc(OC2CCN(CC2)C(=O)C2CCOCC2)cc1)S(F)(F)(F)(F)F
COc1cc(OC2CCN(CC2)C(=O)C2CCOCC2)ccc1-n1c(C)nc2ccc(cc2c1=O)S(F)(F)(F)(F)F |(.78,-31.19,;-.55,-30.42,;-.55,-28.88,;.78,-28.11,;.78,-26.57,;2.12,-25.8,;3.45,-26.57,;3.45,-28.11,;4.78,-28.88,;6.12,-28.11,;6.12,-26.57,;4.78,-25.8,;7.45,-28.88,;7.45,-30.42,;8.78,-28.11,;10.12,-28.88,;11.45,-28.11,;11.45,-26.57,;10.12,-25.8,;8.78,-26.57,;-.55,-25.8,;-1.89,-26.57,;-1.89,-28.11,;-3.22,-28.88,;-3.22,-30.42,;-1.89,-31.19,;-4.55,-31.19,;-5.89,-30.42,;-7.22,-31.19,;-8.55,-30.42,;-8.55,-28.88,;-7.22,-28.11,;-5.89,-28.88,;-4.55,-28.11,;-4.55,-26.57,;-9.89,-28.11,;-11.22,-28.88,;-9.89,-26.57,;-9.89,-29.65,;-8.55,-27.34,;-11.22,-27.34,)|
COc1cc(OCCCN2CCCC2)ccc1-n1c(C)nc2ccc(cc2c1=O)S(F)(F)(F)(F)F |(1.4,-20.92,;.06,-20.15,;.06,-18.61,;1.4,-17.84,;1.4,-16.3,;2.73,-15.53,;4.06,-16.3,;5.4,-15.53,;6.73,-16.3,;8.06,-15.53,;9.47,-16.16,;10.5,-15.01,;9.73,-13.68,;8.22,-14,;.06,-15.53,;-1.27,-16.3,;-1.27,-17.84,;-2.61,-18.61,;-2.61,-20.15,;-1.27,-20.92,;-3.94,-20.92,;-5.27,-20.15,;-6.61,-20.92,;-7.94,-20.15,;-7.94,-18.61,;-6.61,-17.84,;-5.27,-18.61,;-3.94,-17.84,;-3.94,-16.3,;-9.27,-17.84,;-10.61,-18.61,;-9.27,-16.3,;-9.27,-19.38,;-7.94,-17.07,;-10.61,-17.07,)|
Cc1nc2ccc(cc2c(=O)n1-c1ccc(OC2CCN(CC2)C2CC2)cc1)S(F)(F)(F)(F)F
Cc1nc2ccc(cc2c(=O)n1-c1ccc(OC2CCN(CC2)C2CCCC2)cc1)S(F)(F)(F)(F)F
O=C(CN1CCOCC1)Nc1ccc(OC2CCN(CC2)C2CCC2)cc1
CC(N)Cc1ccc2OCOc2c1
COc1cc(cc(c1OC)OC)CCN
COc1cc(CCN)c(OC)cc1Br
CN(C)CCc1c[nH]c2c1cccc2
CN(C)CCc1c[nH]c2c1c(ccc2)O
CCc1cc(OC)c(CCN)cc1OC
CCSc1cc(OC)c(CCN)cc1OC
CCSc1cc(OC)c(CC(C)N)cc1OC
CCOc1cc(OC)c(CC(C)N)cc1OC
COc1ccc2[nH]cc(CCN(C)C(C)C)c2c1
COc1ccc2[nH]cc(CCN(C(C)C)C(C)C)c2c1
CCCN(CCC)CCc1c[nH]c2ccccc12
CCSc1cc(OC)c(CC(N)CC)cc1OC
CN(C)CCc1c[nH]c2cc(F)ccc12
CCN(CC)C(=O)N[C@@H]1CN([C@@H]2Cc3c[nH]c4c3c(ccc4)C2=C1)C
NCCc1c2CCOc2c(Br)c2CCOc12
COc1cc(CC(C)N)c(OC)cc1C
COc1cc(CC(C)N)cc(OC)c1OC
CCc1cc(OC)c(CC(C)N)cc1OC
COc1cc(OC)c(OC)cc1CC(C)N
COc1ccc2[nH]c(C)c(CCN(C)C)c2c1
CCc1[nH]c2ccc(OC)cc2c1CCN(C)C
NC(=N)CCCc1cnc[nH]1
O=C(NC(NCCCc1cnc[nH]1)=NCC1CCCCC1)OCc1ccccc1 |w:13.14|
CC(C)(C)OC(=O)NC(NCCCc1cnc[nH]1)=NCc1ccc(I)cc1 |w:18.19|
CC(C)(C)OC(=O)NC(NCCCCc1cnc[nH]1)=NC1CCCCC1 |w:19.20|
Ic1ccc(CNC(=N)NCCCc2cnc[nH]2)cc1
NC(NCCCCc1cnc[nH]1)=NC1CCCCC1 |w:12.13|
N=C(NCCc1cnc[nH]1)NCCc1ccccc1
N=C(NCCCc1cnc[nH]1)NCC1CCCCC1
CC(C)(C)OC(=O)NC(NCCCc1cnc[nH]1)=NCC1CCCCC1 |w:18.19|
CCOC(=O)NC(NCCCc1cnc[nH]1)=NCC1CCCCC1 |w:16.17|
N#CN=C(NCCCc1cnc[nH]1)NCC1CCCCC1 |w:2.1|
FC(F)(F)Oc1ccc(cc1)S(=O)(=O)NCCCCCc1cnc[nH]1
FC(F)(F)c1ccc(cc1)S(=O)(=O)NCCCCc1cnc[nH]1
Nc1ccc(cc1)S(=O)(=O)NCCCCc1cnc[nH]1
[O-][N+](=O)c1ccc(cc1)S(=O)(=O)NCCCc1cnc[nH]1
FC(F)(F)Oc1ccc(cc1)S(=O)(=O)NCCCCc1cnc[nH]1
O=S(=O)(NCCCCc1cnc[nH]1)c1ccccc1
Clc1ccc(cc1)S(=O)(=O)NCCCCc1cnc[nH]1
Cn1cc[n+](c1)S(=O)(=O)NCCCCc1cnc[nH]1
O=S(=O)(NCCCc1cnc[nH]1)c1cccs1
[O-][N+](=O)c1ccccc1CS(=O)(=O)NCCCCc1cnc[nH]1
Clc1ccc(CN(CCCCc2cnc[nH]2)S(=O)(=O)c2ccc(Cl)cc2)cc1
Clc1ccc(cc1)S(=O)(=O)N(CCCCc1cnc[nH]1)CCCCn1ccnc1
CN(CCCCc1cnc[nH]1)S(=O)(=O)c1ccc(Cl)cc1
COc1ccc(cc1)S(=O)(=O)NCCCCc1cnc[nH]1
CC(C)S(=O)(=O)NCCCCc1cnc[nH]1
O=S(=O)(NCCCCCc1cnc[nH]1)c1ccccc1
O=S(=O)(NCCCCc1cnc[nH]1)c1cccs1
CC(C)(C)c1ccc(cc1)S(=O)(=O)NCCCc1cnc[nH]1
CC(C)(C)c1ccc(cc1)S(=O)(=O)NCCCCCc1cnc[nH]1
Fc1ccc(cc1)S(=O)(=O)NCCCCc1cnc[nH]1
Clc1ccc(cc1)S(=O)(=O)NCCCCCc1cnc[nH]1
CC(C)(C)c1ccc(cc1)S(=O)(=O)NCCCCc1cnc[nH]1
[O-][N+](=O)c1ccc(cc1)S(=O)(=O)NCCCCc1cnc[nH]1
Clc1ccc(cc1)S(=O)(=O)NCCCc1cnc[nH]1
O=S(=O)(Cc1ccccc1)NCCCCc1cnc[nH]1
COc1ccc(CN=C(N)c2ccc(Cc3cnc[nH]3)cc2)cc1 |w:7.6|
N=C(NCCc1ccccc1)c1ccc(Cc2cnc[nH]2)cc1
NC(=NCc1ccc(Cl)cc1)c1ccc(Cc2cnc[nH]2)cc1 |w:2.2|
NC(=N)c1ccc(Cc2cnc[nH]2)cc1
NC(=NCc1ccc(cc1)C(F)(F)F)c1ccc(Cc2cnc[nH]2)cc1 |w:2.2|
NC(=N)c1cccc(Cc2cnc[nH]2)c1
NC(=N)c1cccc(CCc2cnc[nH]2)c1
NC(=N)c1cccc(c1)-c1c[nH]cn1
Clc1ccc(CNC(=N)CCc2ccc(Cc3cnc[nH]3)cc2)cc1
Clc1ccc(CNC(=N)Cc2ccc(Cc3cnc[nH]3)cc2)cc1
NC(=N)c1ccc(CCc2cnc[nH]2)cc1
C[C@H]1CNC[C@H]1c1cnc[nH]1
C[C@H]1NCC[C@@H]1c1cnc[nH]1
CC[C@H]1NCC[C@@H]1c1cnc[nH]1
C[C@@H]1NCC[C@@H]1c1cnc[nH]1
C[C@H]1NCCC[C@@H]1c1cnc[nH]1
C[C@H]1CNC[C@@H]1c1cnc[nH]1 |r|
C1CC(CN1)c1cnc[nH]1
C[C@H]1NC[C@@H]1c1cnc[nH]1
C([C@H]1NCC[C@@H]1c1cnc[nH]1)c1ccccc1
C[C@H]1C[C@@H](CN1)c1cnc[nH]1
C[C@@]1(CCNC1)c1cnc[nH]1
C[C@@H]1CNC[C@H]1c1cnc[nH]1
C[C@H](Cc1cnc[nH]1)N=C(N)NCCSCc1[nH]cnc1C |w:9.10|
C[C@@H](Cc1cnc[nH]1)N=C(N)NCCSCc1[nH]cnc1C |w:9.10|
O=NC1c2ccccc2-c2ccc(OCCN3CCCCC3)cc12
OC(=O)CCNC(=O)N1C[C@@H]2C[C@H]1CN2CCCOc1ccc(cc1)C(=O)C1CC1
O=C(C1CC1)c1ccc(OCCCN2CC[C@@H](C2)NS(=O)(=O)c2ccc(cc2)C#N)cc1 |r|
CC(=O)c1ccc(OCCCN2CC[C@H](N)C2)cc1
Cc1cccn2cc(nc12)-c1ccc(OCCCN2CCCCC2)cc1
CCCCN(CCCC)CCCOc1ccc(cc1)-c1cn2cccc(C)c2n1
Clc1cc(Cl)cc(NC(=O)Nc2ccc(Cc3cnc[nH]3)cc2)c1
Clc1cccc(NC(=O)OCc2ccc(Cc3cnc[nH]3)cc2)c1
Cc1cc(C)cc(NC(=O)NCc2ccc(Cc3cnc[nH]3)cc2)c1
Clc1cc(NC(=O)NCc2ccc(Cc3cnc[nH]3)cc2)cc(Cl)n1
Clc1cc(Cl)cc(NC(=O)OCc2ccc(Cc3cnc[nH]3)cc2)c1
O=C(NCc1ccc(Cc2cnc[nH]2)cc1)Nc1cccc(c1)C#N
Clc1ccc(NC(=O)NCc2ccc(Cc3cnc[nH]3)cc2)cc1
Clc1cc(Cl)cc(NC(=O)NCc2ccc(Cc3cnc[nH]3)cc2)c1
CN(Cc1ccc(Cc2cnc[nH]2)cc1)C(=O)N(C)c1cc(Cl)cc(Cl)c1
Clc1ccc(NC(=O)OCc2ccc(Cc3cnc[nH]3)cc2)cc1
O=C(Nc1ccccc1)OCc1ccc(Cc2cnc[nH]2)cc1
Clc1ccc(NC(=O)OCc2ccc(Cc3cnc[nH]3)cc2)cc1Cl
Clc1ccc(NC(=O)NCc2ccc(Cc3cnc[nH]3)cc2)cc1Cl
Clc1cccc(NC(=O)NCc2ccc(Cc3cnc[nH]3)cc2)c1
FC(F)(F)c1cc(NC(=O)NCc2ccc(Cc3cnc[nH]3)cc2)cc(c1)C(F)(F)F
Clc1ccccc1CCNC(=O)NCc1ccc(Cc2cnc[nH]2)cc1
Clc1ccccc1NC(=O)NCc1ccc(Cc2cnc[nH]2)cc1
O=C(NCc1ccc(Cc2cnc[nH]2)cc1)Nc1cccnc1
FC(F)(F)c1cccc(NC(=O)NCc2ccc(Cc3cnc[nH]3)cc2)c1
COc1cccc(NC(=O)NCc2ccc(Cc3cnc[nH]3)cc2)c1
FC(F)(F)c1cc(CNC(=O)NCc2ccc(Cc3cnc[nH]3)cc2)cc(c1)C(F)(F)F
CN(CCCCc1cnc[nH]1)CCC(c1ccc(Cl)cc1)c1ccccn1
Clc1ccc(cc1)C(CCNC(=O)NCCCCc1cnc[nH]1)c1ccccn1
Clc1ccc(cc1)C(CC(=N)NCCc1cnc[nH]1)c1ccccn1
Clc1ccc(cc1)C(CCNC(=N)CCCc1cnc[nH]1)c1ccccn1
Clc1ccc(cc1)C(CC(=O)NCCCCc1cnc[nH]1)c1ccccn1
C(CCc1cnc[nH]1)CNCCC(c1ccccn1)c1ccccn1
CN(CCCCc1cnc[nH]1)C(=O)CC(c1ccc(Cl)cc1)c1ccccn1
Clc1ccc(cc1)C(CCNC(=O)CCc1cnc[nH]1)c1ccccn1
CN(CCCc1cnc[nH]1)CCC(c1ccc(Cl)cc1)c1ccccn1
Clc1ccc(cc1)C(CC(=O)NCCc1cnc[nH]1)c1ccccn1
Clc1ccc(cc1)C(CCNCCCCc1cnc[nH]1)c1ccccn1
Clc1ccc(cc1)C(CCNCCCCCc1cnc[nH]1)c1ccccn1
CN(CCC(c1ccc(Cl)cc1)c1ccccn1)C(=O)CCc1cnc[nH]1
Clc1ccc(cc1)C(CCNCCCc1cnc[nH]1)c1ccccn1
O=C(CC(c1ccccn1)c1ccccn1)NCCCCc1cnc[nH]1
CN(CCc1cnc[nH]1)C(=O)CC(c1ccc(Cl)cc1)c1ccccn1
CN(CCCCCc1cnc[nH]1)CCC(c1ccc(Cl)cc1)c1ccccn1
Clc1ccc(cc1)C(CCNCCc1cnc[nH]1)c1ccccn1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)-c3ccccc3)c(F)c2)CC1
O[C@@H]1CCN(CCc2cc3cc(ccc3o2)-c2ccc(cc2)C(=O)N2CCOCC2)C1 |r|
Ic1ccc(CC(=O)OCCCc2cnc[nH]2)cc1
Brc1ccc(COCCCc2cnc[nH]2)cc1
COc1ccc(CCC(=O)OCCCc2cnc[nH]2)cc1I
Ic1cccc(OCCCc2cnc[nH]2)c1
Nc1c(I)cc(cc1I)C(=O)OCCCc1cnc[nH]1
Ic1ccc(CCC(=O)OCCCc2cnc[nH]2)cc1
Ic1cccc(NC(=O)OCCCc2cnc[nH]2)c1
Cc1ccc(cc1I)C(=O)OCCCc1cnc[nH]1
Ic1ccccc1NC(=O)OCCCc1cnc[nH]1
Ic1cccc(c1)C(=O)OCCCc1cnc[nH]1
Ic1ccc(CNC(=O)OCCCc2cnc[nH]2)cc1
Ic1ccc(CCCC(=O)OCCCc2cnc[nH]2)cc1
Ic1ccccc1C(=O)OCCCc1cnc[nH]1
OCCCc1cnc[nH]1
Ic1cccc(COCCCc2cnc[nH]2)c1
Ic1ccc(NC(=O)OCCCc2cnc[nH]2)cc1
Ic1ccc(cc1)C(=O)OCCCc1cnc[nH]1
Ic1ccc(CCCOCCCc2cnc[nH]2)cc1
Ic1ccc(OCCCc2cnc[nH]2)cc1
[O-][N+](=O)c1ccc(NCCc2cnc[nH]2)nc1
C(Cc1cnc[nH]1)Nc1ccccn1
FC(F)(F)c1ccc(NCCc2cnc[nH]2)nc1
COC(=O)c1ccc(NCCc2cnc[nH]2)nc1
C(Cc1ccccn1)Nc1ncccn1
FC(F)(F)c1ccc(nc1)N1CCC(CC1)c1cnc[nH]1
[O-][N+](=O)c1ccc(SCCc2cnc[nH]2)nc1
[O-][N+](=O)c1ccc(NCCCc2cnc[nH]2)nc1
C(Cc1cnc[nH]1)Nc1cnccn1
S=C(NCCCc1cnc[nH]1)NC1CCCCC1
[O-][N+](=O)c1ccc(NCCSCc2cnc[nH]2)nc1
Nc1ccc(NCCc2cnc[nH]2)nc1
[O-][N+](=O)c1cccnc1NCCc1cnc[nH]1
[O-][N+](=O)c1cc[n+]([O-])c(NCCc2cnc[nH]2)c1
C(Cc1cnc[nH]1)Nc1nccs1
Clc1cc(NCCc2cnc[nH]2)ccn1
C(Cc1cnc[nH]1)Nc1nc2ccccc2s1
C(Cc1cnc[nH]1)Sc1ncc[nH]1
S=C(NCCCCc1cnc[nH]1)NC1CCCCC1
C(Cc1cnc[nH]1)Sc1ccccn1
C[C@@H](N)[C@@H](C)c1cnc[nH]1
N[C@H]1CCC[C@@H]1c1cnc[nH]1
C[C@@H]1NCC[C@H]1c1cnc[nH]1
C[C@@H](N)[C@H](C)c1cnc[nH]1
C[C@@]1(N)CCCC[C@@H]1c1cnc[nH]1
C[C@]1(N)CCCC[C@@H]1c1cnc[nH]1
N[C@H]1C[C@H]1c1cnc[nH]1
NC[C@@H]1C[C@H]1c1cnc[nH]1
NC[C@H]1C[C@H]1c1cnc[nH]1
NC[C@H]1C[C@@H]1c1cnc[nH]1
Cc1nccn1C[C@H]1CCc2c(C1=O)c1cccc3CCCn2c13
Cc1nccn1CC2CCc3c(c4ccccc4n3C)C2=O
CC(=O)NC(N)=NCCCc1cnc[nH]1 |w:6.6|
CCC(=O)NC(N)=NCCCc1cnc[nH]1 |w:7.7|
CC(C)C(=O)NC(N)=NCCCc1cnc[nH]1 |w:8.8|
CN(CCC(=O)NC(N)=NCCCc1cnc[nH]1)C(=O)c1cc2ccccc2[nH]1 |w:9.9|
NC(NC(=O)CNC(=O)c1cc2ccccc2[nH]1)=NCCCc1cnc[nH]1 |w:18.20|
NC(N)=NCCCc1cnc[nH]1 |(34.52,3.88,;33.18,4.65,;33.18,6.19,;31.85,3.88,;30.52,4.65,;29.18,3.88,;27.85,4.65,;26.51,3.88,;26.53,2.34,;25.07,1.85,;24.15,3.09,;25.05,4.34,)|
CC(CC(=O)NC(N)=NCCCc1cnc[nH]1)c1ccccc1 |w:8.8|
CCCC(=O)NC(N)=NCCCc1cnc[nH]1 |w:8.8|
Cc1nnc(C)n1-c1ccc(OCCCN2CCCCC2)cc1
Cc1nnc(-c2cccnc2)n1-c1ccc(OCCCN2CCCCC2)cc1
C[C@H](NCc1ccc(OCCCN2CCCCC2)cc1)C(N)=O |r|
O=C1NC(C(=O)N1CCCN1CCCCC1)(c1ccccc1)c1ccccc1
O=C1NC(C(=O)N1Cc1ccc(OCCCN2CCCCC2)cc1)(c1ccccc1)c1ccccc1
Clc1ccc(CCCOCCCN2CCCCC2)cc1
O=C(NC1CCCCC1)OCCCc1cnc[nH]1
FC(F)(F)c1cccc(NC(=O)OCCCc2cnc[nH]2)c1
[O-][N+](=O)c1ccc(CNC(=O)OCCCc2cnc[nH]2)cc1
O=C(NCc1ccccc1)OCCCc1cnc[nH]1
O=C(NCc1ccco1)OCCCc1cnc[nH]1
Cc1ccc(NC(=O)OCCCc2cnc[nH]2)cc1
CN(Cc1ccccc1)C(=O)OCCCc1cnc[nH]1
CC(NC(=O)OCCCc1cnc[nH]1)c1ccccc1
[O-][N+](=O)c1ccc(NC(=O)OCCCc2cnc[nH]2)cc1
C[C@H](NC(=O)OCCCc1cnc[nH]1)c1ccccc1
[O-][N+](=O)c1cccc(CNC(=O)OCCCc2cnc[nH]2)c1
O=C(NCC1=CC=CC1[Fe++]C1C=CC=C1)OCCCc1cnc[nH]1 |c:6,12,14,t:4|
O=C(NCc1cccc(CNC(=O)OCCCc2cnc[nH]2)c1)OCCCc1cnc[nH]1
O=C(NCC1CCCCC1)OCCCc1cnc[nH]1
O=C(OCCCc1cnc[nH]1)N(c1ccccc1)c1ccccc1
Clc1ccc(NC(=O)OCCCc2cnc[nH]2)cc1
O=C(Nc1ccc2ccccc2c1)OCCCc1cnc[nH]1
FC(F)(F)c1cccc(CNC(=O)OCCCc2cnc[nH]2)c1
Brc1ccc(NC(=O)OCCCc2cnc[nH]2)cc1
O=C(NC(=O)c1ccccc1)OCCCc1cnc[nH]1
Clc1ccc(CNC(=O)OCCCc2cnc[nH]2)cc1
O=C(NCCc1ccccc1)OCCCc1cnc[nH]1
FC(F)(F)c1ccc(NC(=O)OCCCc2cnc[nH]2)cc1
FC(F)(F)c1ccccc1NC(=O)OCCCc1cnc[nH]1
S=C(Nc1ccccc1)OCCCc1cnc[nH]1
O=C(NCC1CC1)OCCCc1cnc[nH]1
CCN(Cc1ccccc1)C(=O)OCCCc1cnc[nH]1
O=C(NCc1cccs1)OCCCc1cnc[nH]1
O=C(NCCCc1ccccc1)OCCCc1cnc[nH]1
[O-][N+](=O)c1ccccc1NC(=O)OCCCc1cnc[nH]1
O=C(Nc1ccccc1)OCCCc1cnc[nH]1
O=C(NCC1CCC1)OCCCc1cnc[nH]1
Fc1ccc(CNC(=O)OCCCc2cnc[nH]2)cc1
Nc1ccc(NC(=O)OCCCc2cnc[nH]2)cc1
[O-][N+](=O)c1cccc(NC(=O)OCCCc2cnc[nH]2)c1
Nc1ccc(CNC(=O)OCCCc2cnc[nH]2)cc1
O=C(NN1CCC(CC1)c1ccccc1)OCCCc1cnc[nH]1
C[C@@H](NC(=O)OCCCc1cnc[nH]1)c1ccccc1
CN(C)c1ccc(NC(=O)OCCCc2cnc[nH]2)cc1
FC(F)(F)c1ccc(CNC(=O)OCCCc2cnc[nH]2)cc1
Fc1ccc(NC(=O)OCCCc2cnc[nH]2)cc1
O=C(NCC1CCCC1)OCCCc1cnc[nH]1
FC(F)(F)Oc1ccc(NC(=O)OCCCc2cnc[nH]2)cc1
Nc1nc(cc(n1)N1CCNCC1)C1CCCC1
CCc1cc(nc(N)n1)N1CC[C@H](C1)NC |r|
CC(C)c1cc(nc(N)n1)N1CC[C@@H](N)C1 |r|
COc1ccc(OCCc2cnc[nH]2)cc1
Cc1ccc(OCCc2cnc[nH]2)cc1
[O-][N+](=O)c1ccc(SCCc2cnc[nH]2)cc1
Fc1ccc(OCCCc2cnc[nH]2)cc1
COC(=O)c1ccc(OCCc2cnc[nH]2)cc1
C(Cc1cnc[nH]1)Oc1ccc2ccccc2c1
Brc1ccc(OCCc2cnc[nH]2)cc1
N#Cc1ccc(OCCCc2cnc[nH]2)cc1
[O-][N+](=O)c1ccc(OCCc2cnc[nH]2)cc1
[O-][N+](=O)c1ccc(NCCc2cnc[nH]2)cc1
CCOC(=O)c1ccc(OCCc2cnc[nH]2)cc1
N#Cc1ccccc1OCCc1cnc[nH]1
N#Cc1cccc(OCCc2cnc[nH]2)c1
CCc1ccc(OCCc2cnc[nH]2)cc1
FC(F)(F)c1ccc(OCCc2cnc[nH]2)cc1
Fc1c(F)c(F)c(OCCc2cnc[nH]2)c(F)c1F
N#Cc1ccc(OCCc2cnc[nH]2)cc1
CCCc1ccc(OCCc2cnc[nH]2)cc1
[O-][N+](=O)c1ccc(CSCc2cnc[nH]2)cc1
O=C(N1CCCCC1)c1ccc(OCCc2cnc[nH]2)cc1
[O-][N+](=O)c1cccc(OCCc2cnc[nH]2)c1
Clc1cc(Cl)cc(OCCc2cnc[nH]2)c1
CC(=O)c1ccc(OCCc2cnc[nH]2)cc1
O=C(c1ccccc1)c1ccc(OCCc2cnc[nH]2)cc1
C(Cc1cnc[nH]1)Oc1cccc2ccccc12
Clc1ccc(OCCc2cnc[nH]2)cc1
FC(F)(F)c1ccc(OCCCc2cnc[nH]2)cc1
CCC(=O)c1ccc(OCCc2cnc[nH]2)cc1
CCNC(=O)C1CCN(Cc2ccc(OCCCN3CCCCC3)cc2)CC1
O=C(NCC#C)C1CCN(Cc2ccc(OCCCN3CCCCC3)cc2)CC1
OC(=O)C1CCN(Cc2ccc(OCCCN3CCCCC3)cc2)CC1
Cc1nnc(o1)C1CCN(Cc2ccc(OCCCN3CCCCC3)cc2)CC1
C(COc1ccc(CN2CCc3ccccc3C2)cc1)CN1CCCCC1
CCOC(=O)C1CCN(Cc2ccc(OCCCN3CCCCC3)cc2)CC1
C(COc1ccc(CN2CCC3(CC2)OCCO3)cc1)CN1CCCCC1
OCC1CCN(Cc2ccc(OCCCN3CCCCC3)cc2)CC1
OC1CCN(Cc2ccc(OCCCN3CCCCC3)cc2)CC1
O=C1CCN(Cc2ccc(OCCCN3CCCCC3)cc2)CC1
CS(=O)(=O)OC1CCN(Cc2ccc(OCCCN3CCCCC3)cc2)CC1
FC1CCN(Cc2ccc(OCCCN3CCCCC3)cc2)CC1
CN1CCN(CC1)c1nc(N)nc(n1)-c1ccc(Cl)cc1
CN1CCN(CC1)c1nc(N)nc(n1)-c1ccc(Br)cc1
CC#Cc1ccc(OCCCc2cnc[nH]2)cc1
CCCC#Cc1ccc(OCCCc2cnc[nH]2)cc1
C#Cc1ccc(OCCCc2cnc[nH]2)cc1
C[Si](C)(C)C#Cc1ccc(OCCCc2cnc[nH]2)cc1
CC(C)(C)C#Cc1ccc(OCCCc2cnc[nH]2)cc1
Cn1cncc1CCN
C(CC1CCCCC1)C#CCCc1cnc[nH]1
CC(C)CCC#CCCc1cnc[nH]1
Clc1ccc(Cc2noc(CCc3cnc[nH]3)n2)cc1
CC(C)(C)CCC#CCCc1cnc[nH]1
CCCC#CCCc1cnc[nH]1
C(CCc1ccccc1)CC#CCCc1cnc[nH]1
COc1ccc(CC(N=O)C(=O)NCCc2cnc[nH]2)cc1Br
C(CC1CCCC1)C#CCCc1cnc[nH]1
CCC#CCCc1cnc[nH]1
CCCCCCCC=Cc1cnc[nH]1 |w:7.6|
C(Cc1ccccc1)C=Cc1cnc[nH]1 |w:8.8|
C(CCCc1ccccc1)CCc1cnc[nH]1
CCCCCCCCCc1cnc[nH]1
C(Cc1cnc[nH]1)C=CCCc1ccccc1 |w:8.9|
C(CCc1ccccc1)Cc1cnc[nH]1
CCCCCCCCNC(=O)OCCCc1cnc[nH]1
CCCC(C)NC(=O)OCCCc1cnc[nH]1
CCCC[C@H](C)NC(=O)OCCCc1cnc[nH]1
CCC(C)CNC(=O)OCCCc1cnc[nH]1
CCCCC[C@@H](C)NC(=O)OCCCc1cnc[nH]1
CCCCCCCNC(=O)OCCCc1cnc[nH]1
CCCCNC(=O)OCCCc1cnc[nH]1
CC[C@H](C)CNC(=O)OCCCc1cnc[nH]1
CCCCCCC(C)NC(=O)OCCCc1cnc[nH]1
CCCCCCNC(=O)OCCCc1cnc[nH]1
CC[C@@H](C)NC(=O)OCCCc1cnc[nH]1
CCCCCC(C)NC(=O)OCCCc1cnc[nH]1
CCCCC(C)NC(=O)OCCCc1cnc[nH]1
CC(C)CNC(=O)OCCCc1cnc[nH]1
CCC(C)CCNC(=O)OCCCc1cnc[nH]1
CSCCCNC(=O)OCCCc1cnc[nH]1
CC[C@H](C)NC(=O)OCCCc1cnc[nH]1
CCCNC(=O)OCCCc1cnc[nH]1
CC(C)NC(=O)OCCCc1cnc[nH]1
CCCC[C@@H](C)NC(=O)OCCCc1cnc[nH]1
CCCCCNC(=O)OCCCc1cnc[nH]1
COCCCNC(=O)OCCCc1cnc[nH]1
CC(C)CCNC(=O)OCCCc1cnc[nH]1
CCCC(C)CNC(=O)OCCCc1cnc[nH]1
CCC[C@@H](C)NC(=O)OCCCc1cnc[nH]1
CCC(C)NC(=O)OCCCc1cnc[nH]1
CCCCC[C@H](C)NC(=O)OCCCc1cnc[nH]1
CCNC(=O)OCCCc1cnc[nH]1
CCCC#CC1CC1c1cnc[nH]1
CCCCCC#CCCc1cnc[nH]1
C(CC1CCCCC1)C#CC1CC1c1cnc[nH]1
CC(C)CCC#CC1CC1c1cnc[nH]1
C#CCCc1cnc[nH]1
CC(C)(C)CCC#CC1CC1c1cnc[nH]1
CCCCCCCC#CCCc1cnc[nH]1
C(CC1CCCC1)C#CC1CC1c1cnc[nH]1
C(CCc1ccccc1)CC#CC1CC1c1cnc[nH]1
CC(C)(C)CCC#C[C@H]1C[C@@H]1c1cnc[nH]1 |r|
CC(C)(C)CNC(=O)OCCCc1cnc[nH]1
CC(C)(C)CC(C)(C)NC(=O)OCCCc1cnc[nH]1
Cc1nc2cccc(c2c(=O)n1-c1ccc(OCCCN2CCCC2)cc1)C(F)(F)F
[O-][N+](=O)c1ccc(OCCCCCN2CCCC2)cc1
CC(C)(C)c1ccc(NCCc2cnc[nH]2)cc1
C(Cc1cnc[nH]1)Nc1ccccc1
CC(C)(C)c1cccc(NCCc2cnc[nH]2)c1
Cc1ccc(NCCc2cnc[nH]2)cc1
Cc1ccc(NCCc2cnc[nH]2)cc1C
COc1ccc(SCCc2cnc[nH]2)cc1
C(Cc1cnc[nH]1)NC1CCCCC1
CC(C)(C)c1ccc(SCCc2cnc[nH]2)cc1
FC(F)(F)c1ccc(SCCc2cnc[nH]2)cc1
CCCCCC(N=O)c1ccc(OCCCc2cnc[nH]2)cc1
CC(N=O)c1ccc(OCCCc2cnc[nH]2)cc1C
CC(NO)c1ccc(OCCCc2cnc[nH]2)cc1
CC(N=O)c1ccc(OCCCc2cnc[nH]2)cc1F
N#CCc1ccc(OCCCc2cnc[nH]2)cc1
O=NC(C1CC1)c1ccc(OCCCc2cnc[nH]2)cc1
CO\N=C(/C)c1ccc(OCCCc2cnc[nH]2)cc1
CC(N=O)c1ccc(OCCCc2cnc[nH]2)c(C)c1
CC(O)c1ccc(OCCCc2cnc[nH]2)cc1
COc1cc(OCCCc2cnc[nH]2)ccc1C(C)N=O
CC(C)C(O)c1ccc(OCCCc2cnc[nH]2)cc1
CCC(N=O)c1ccc(OCCCc2cnc[nH]2)cc1
ONC(=N)c1ccc(OCCCc2cnc[nH]2)cc1
CC(C)(C)CC(N=O)c1ccc(OCCCc2cnc[nH]2)cc1
CC(N=O)c1ccc(OCCCc2cnc[nH]2)cc1
NNC(=O)c1ccc(OCCCc2cnc[nH]2)cc1
CC(=O)c1ccc(OCCCc2cnc[nH]2)cc1
NC(=O)c1ccc(OCCCc2cnc[nH]2)cc1
CCCC(O)c1ccc(OCCCc2cnc[nH]2)cc1
CO\N=C\c1ccc(OCCCc2cnc[nH]2)cc1
[O-][N+](=O)c1ccc(OCCCc2cnc[nH]2)cc1
O=NCc1ccc(OCCCc2cnc[nH]2)cc1
O=C(N1CCCC1)c1ccc(OCCCc2cnc[nH]2)cc1
CC(=NNC(N)=O)c1ccc(OCCCc2cnc[nH]2)cc1 |w:2.2|
COC(=O)c1ccc(OCCCc2cnc[nH]2)cc1
C\C(=N/OCc1ccccc1)c1ccc(OCCCc2cnc[nH]2)cc1
CN(C)S(=O)(=O)c1ccc(OCCCc2cnc[nH]2)cc1
CCCCC(N=O)c1ccc(OCCCc2cnc[nH]2)cc1
CCCC(N=O)c1ccc(OCCCc2cnc[nH]2)cc1
O=C(C1CC1)c1ccc(OCc2cnc[nH]2)cc1
O=C(C1CC1)c1ccc(OCCCCc2cnc[nH]2)cc1
CCCCc1ccc(OCCCc2cnc[nH]2)cc1
OCCCC(=O)c1ccc(OCCCc2cnc[nH]2)cc1
OC(C1CC1)c1ccc(OCCCc2cnc[nH]2)cc1
O=C(C1CC1)c1ccc(OCCc2cnc[nH]2)cc1
OCCCC1(OCCO1)c1ccc(OCCCc2cnc[nH]2)cc1
CC(=O)c1ccc(SCCc2cnc[nH]2)cc1
C(COc1ccccc1)Cc1cnc[nH]1
CC(=O)c1ccc(SCCCc2cnc[nH]2)cc1
COc1ccc(OCCCc2cnc[nH]2)cc1
CC(=O)c1ccc(OCCCCc2cnc[nH]2)cc1
Nc1nc2ccccc2nc1NC(=O)c1ccc(CN2CCCCC2)cc1
Nc1nc2ccccc2nc1C(=O)Nc1ccc(CN2CCCC2)cc1
Clc1ccc2c(NCCCCCCCN3CCCCC3)ccnc2c1
CN(CCCN1CCCCC1)c1c2CCCCc2nc2ccccc12
C(CCN1CCCCC1)CNc1ccnc2ccccc12
C(COc1ccc(CCCNc2ccnc3ccccc23)cc1)CN1CCCCC1
C(CNc1ccnc2ccccc12)CN1CCCCC1
C(COc1ccc(Nc2ccnc3ccccc23)cc1)CN1CCCCC1
CN(CCN1CCCCC1)c1c2CCCCc2nc2ccccc12
Clc1ccc2c(NCCCCCCN3CCCCC3)ccnc2c1
CCN(CCCN1CCCCC1)c1ccnc2ccccc12
C(CNc1c2CCCCc2nc2ccccc12)CN1CCCCC1
C(COc1ccc(CCNc2c3CCCCc3nc3ccccc23)cc1)CN1CCCCC1
C(CNc1c2ccccc2nc2ccccc12)CN1CCCCC1
Clc1ccc2c(NCCCCCN3CCCCC3)ccnc2c1
Clc1ccc2c(NCCCN3CCCCC3)ccnc2c1
Clc1ccc2c(NCCCCCCCCCCCCN3CCCCC3)ccnc2c1
C(CCCN1CCCCC1)CCNc1ccnc2ccccc12
C(CCCN1CCCCC1)CCNc1c2CCCCc2nc2ccccc12
C(CN1CCCCC1)Nc1c2CCCCc2nc2ccccc12
Clc1ccc2c(Nc3ccc(OCCCN4CCCCC4)cc3)ccnc2c1
C(COc1ccc(CCCNc2c3CCCCc3nc3ccccc23)cc1)CN1CCCCC1
CN(CCCN1CCCCC1)c1ccnc2ccccc12
Cc1cnc2ccccc2c1NCCCCCCN1CCCCC1
CN(CCN1CCCCC1)c1ccnc2ccccc12
C(CCc1ccc(OCCCN2CCCCC2)cc1)CNc1ccnc2ccccc12
Cc1cnc2ccccc2c1NCCCN1CCCCC1
Clc1ccc2c(NCCCCCCCCCCN3CCCCC3)ccnc2c1
C(CCNc1ccnc2ccccc12)CCN1CCCCC1
Clc1ccc2c(NCCCCCCCCN3CCCCC3)ccnc2c1
C(CN1CCCCC1)Nc1ccnc2ccccc12
Clc1ccc2c(NCCCCN3CCCCC3)ccnc2c1
C(COc1ccc(CCNc2ccnc3ccccc23)cc1)CN1CCCCC1
O=NC1c2ccccc2-c2ccc(OCCN3CCCC3)cc12
OC1c2ccccc2-c2ccc(OCCN3CCCCC3)cc12
CN1CCCCC(C1)Oc1ccc-2c(c1)C(N=O)c1ccccc-21
CN(C)CCCOc1ccc-2c(c1)C(N=O)c1ccccc-21
CN(C)C1c2ccccc2-c2ccc(OCCN3CCCCC3)cc12
CN1CCCC(COc2ccc-3c(c2)C(N=O)c2ccccc-32)C1
O=NC1c2ccccc2-c2ccc(OCCN3CCOCC3)cc12
OCC1c2ccccc2-c2ccc(OCCN3CCCCC3)cc12
CN1CCCC1CCOc1ccc-2c(c1)C(N=O)c1ccccc-21
CN(C)CCOc1ccc-2c(c1)C(N=O)c1ccccc-21
CCCCC1CCN(CCCC(=O)c2ccccc2C)CC1
O=C(Cc1ccccc1)NC1CCN(CCCN2C(=O)COc3ccccc23)CC1
O=C(C1CC1)c1ccc(OCCCN2C[C@@H]3C[C@H]2CN3C(=O)c2ccccn2)cc1
Fc1cccc(c1)S(=O)(=O)N[C@H]1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)C1
CC(=O)c1ccc(OCCCN2CC[C@@H](C2)NC(=O)c2csc(n2)-c2cccnc2)cc1
O=C(C1CC1)c1ccc(OCCCN2CC[C@@H](C2)NS(=O)(=O)c2ccccc2)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)OCC)cc1
CC(=O)c1ccc(OCCCN2CC[C@@H](C2)NC(=O)c2cnccn2)cc1
Clc1ccccc1S(=O)(=O)N[C@H]1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)C1
Clc1cccc(c1)S(=O)(=O)N[C@H]1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)C1
Fc1ccccc1S(=O)(=O)N[C@H]1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)C1
C[C@@H](NC(=O)N1C[C@@H]2C[C@H]1CN2CCCOc1ccc(cc1)C(=O)C1CC1)C(O)=O
Cc1cccc(c1)S(=O)(=O)N[C@H]1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)C1
O=C(N[C@H]1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)C1)c1csc(n1)-c1cccnc1
Cc1ccc(cc1)S(=O)(=O)N[C@H]1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)C1
Fc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H]1CN2CCCOc1ccc(cc1)C(=O)C1CC1
CC(C)(C)OC(=O)NCCC(=O)N1C[C@@H]2C[C@H]1CN2CCCOc1ccc(cc1)C(=O)C1CC1
CC(C)(C)c1ccc(cc1)S(=O)(=O)N[C@H]1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)C1
C[C@H](NC(=O)N1C[C@@H]2C[C@H]1CN2CCCOc1ccc(cc1)C(=O)C1CC1)C(O)=O
Cn1cnc(c1)S(=O)(=O)N[C@H]1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)C1
Fc1ccc(cc1)S(=O)(=O)N[C@H]1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)C1
CC(=O)c1ccc(OCCCN2CC[C@@H](C2)NC(=O)[C@@H](N)CO)cc1
CCc1ccc(cc1)S(=O)(=O)N[C@H]1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)C1
C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H]1CCN(CCCOc2ccc(cc2)C(C)=O)C1
Clc1ccc(cc1)S(=O)(=O)N[C@H]1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)C1
CC(=O)c1ccc(OCCCN2CC[C@@H](C2)NC(=O)[C@H](CO)NC(=O)OC(C)(C)C)cc1
O=C(C1CC1)c1ccc(OCCCN2C[C@@H]3C[C@H]2CN3C(=O)c2ccco2)cc1
CC(=O)c1ccc(OCCCN2CC[C@@H](C2)NC(=O)c2cccnc2)cc1
C[C@@H](N(C(=O)OC(C)(C)C)C(=O)N1C[C@@H]2C[C@H]1CN2CCCOc1ccc(cc1)C(=O)C1CC1)C(O)=O
O=C(C1CC1)c1ccc(OCCCN2C[C@@H]3C[C@H]2CN3C(=O)c2ccccc2)cc1
CCS(=O)(=O)N1C[C@@H]2C[C@H]1CN2CCCOc1ccc(cc1)C(=O)C1CC1
CC(=O)c1ccc(OCCCN2CC[C@@H](C2)NS(=O)(=O)c2ccc(cc2)C#N)cc1
CC(=O)c1ccc(OCCCN2CC[C@@H](C2)NC(=O)[C@@H](CO)NC(=O)OC(C)(C)C)cc1
O=C(C1CC1)c1ccc(OCCCN2CC[C@@H](C2)NS(=O)(=O)c2cccc(c2)C#N)cc1
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@H]1CCN(CCCOc2ccc(cc2)C(C)=O)C1
C[C@H](N(C(=O)OC(C)(C)C)C(=O)N1C[C@@H]2C[C@H]1CN2CCCOc1ccc(cc1)C(=O)C1CC1)C(O)=O
Cc1ccccc1S(=O)(=O)N[C@H]1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)C1
CC(C)(C)CC(=O)N1C[C@@H]2C[C@H]1CN2CCCOc1ccc(cc1)C(=O)C1CC1
CC(=O)c1ccc(OCCCN2CC[C@@H](C2)NC(=O)c2ccc(cc2)C#N)cc1
Brc1ccc(cc1)S(=O)(=O)N[C@H]1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)C1
O=C(C1CC1)c1ccc(OCCCN2C[C@@H]3C[C@H]2CN3C(=O)C2CCCCC2)cc1
O=C(C1CC1)c1ccc(OCCCN2CC[C@@H](C2)NS(=O)(=O)c2ccccc2C#N)cc1
COc1ccc(cc1)S(=O)(=O)N[C@H]1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)C1
O=C(C1CC1)c1ccc(OCCCN2C[C@@H]3C[C@H]2CN3S(=O)(=O)c2ccccc2)cc1
CCCCN(CCCC)CCCOc1ccc(cc1)-c1nc2c(C)cccn2c1C
Cc1cccn2cc(nc12)-c1ccc(NCCCN2CCCCC2)cc1
CCCCN(CCCC)CCCOc1ccc(cc1OC)-c1cn2cccc(C)c2n1
CCCCN(CCCC)CCCOc1ccc(-c2cn3cccc(C)c3n2)c(C)c1
Cc1ccn2cc(nc2c1)-c1ccc(OCCCN2CCCCC2)cc1
C(COc1ccc(cc1)-c1cn2ccccc2n1)CN1CCCCC1
Cc1ccn2cc(nc2c1)-c1ccc(OCCCN2CCCC2)cc1
CCCCN(CCCC)CCCOc1ccc(cc1)-c1cn2cccc(OCc3ccccc3)c2n1
CCCCN(CCCC)CCCOc1c(OC)cc(cc1OC)-c1cn2cccc(C)c2n1
Cc1cc(ccc1OCCCN1CCCCC1)-c1cn2ccccc2n1
CC(N(CCCOc1ccc(cc1)-c1cn2cccc(C)c2n1)C(C)c1ccccc1)c1ccccc1
CN(C)CCCOc1ccc(cc1)-c1cn2cccc(C)c2n1
Cc1ccn2cc(nc2c1)-c1ccc(OCCCN2CCCCC2)cc1F
Cc1cccn2cc(nc12)-c1ccc(NS(=O)(=O)CCCN2CCCCC2)cc1
CCCCCN(CCCCC)CCCOc1ccc(cc1)-c1cn2cccc(C)c2n1
CCCCN(CCCC)CCCOc1ccc(cc1)-c1cn2cccc([N+]([O-])=O)c2n1
CCCCN(CCCC)CCCOc1ccc(cc1)-c1cn2cc(C)ccc2n1
CCCCN(CCCC)CCCOc1ccc(cc1)-c1cn2c(C)cc(C)cc2n1
CCCCN(CCCC)CCCOc1ccc(cc1)-c1cn2cc(Br)ccc2n1
CCCCN(CCCC)CCCOc1ccc(cc1)-c1cn2cc(Br)cc(Br)c2n1
Cc1cccn2cc(nc12)-c1ccc(OCCCNCc2ccccc2)cc1
Cc1ccn2cc(nc2c1)-c1ccc(OCCCN2CCCCC2)cc1C
Cc1cccn2cc(nc12)-c1ccc(OCCCn2ccnc2)cc1
Cc1ccn2cc(nc2c1)-c1ccc(cc1)C#CCCN1CCCCC1
Cc1ccn2cc(nc2c1)-c1ccc(OCCCN2CCCCCC2)cc1
Cc1ccn2cc(nc2c1)-c1ccc(\C=C\CCN2CCCCC2)cc1
CCCCN(CCCC)CCCOc1ccc(cc1C)-c1cn2cccc(C)c2n1
CCCCN(CCCC)CCCOc1ccc(cc1)-c1cn2ccc(C)cc2n1
Cc1ccn2cc(nc2c1)-c1ccc(CCCCN2CCCCC2)cc1
CCCCN(CCCC)CCCOc1ccc(cc1)-c1cn2c(C)cccc2n1
COc1cc(ccc1OCCCN1CCCCC1)-c1cn2ccc(C)cc2n1
Cc1cccn2cc(nc12)-c1ccc(NC(=O)CCN2CCCCC2)cc1
CCCN(CCC)CCCOc1ccc(cc1)-c1cn2cccc(C)c2n1
Cc1cccn2cc(nc12)-c1ccc(OCCCN2CCOCC2)cc1
CCCCN(CCCC)CCCOc1ccc(cc1)-c1cn2cccc(O)c2n1
CCCCN(CCCC)CCCOc1ccc(cc1)-c1cn2ccccc2n1
N[C@@H]1C[C@@H]1c1cnc[nH]1
NC[C@@H]1C[C@@H]1c1cnc[nH]1
N[C@H]1C[C@@H]1c1cnc[nH]1
N[C@@H]1C[C@H]1c1cnc[nH]1
NCC[C@H]1C[C@H]1c1cnc[nH]1
NCC[C@@H]1C[C@@H]1c1cnc[nH]1
Cc1ccc2cc(cn2c1)-c1ccc(OCCCN2CCCCC2)cc1
C(COc1ccc(cc1)-c1cc2ccccn2n1)CN1CCCCC1
Cc1c(cc2ccccn12)-c1ccc(OCCCN2CCCCC2)cc1
Cc1cccn2cc(cc12)-c1ccc(OCCCN2CCCCC2)cc1
Cc1c(cn2ccccc12)-c1ccc(OCCCN2CCCCC2)cc1
Cc1c(cn2ccccc12)-c1ccc(OCCCN2CCCCC2)cc1C
C(COc1ccc(cc1)-c1cc2ccccc2[nH]1)CN1CCCCC1
C(COc1ccc(cc1)-c1cn2ccccc2c1CCc1ccccc1)CN1CCCCC1
C(COc1cccc(c1)-c1cc2ccccn2c1)CN1CCCCC1
C(COc1ccccc1-c1cc2ccccn2c1)CN1CCCCC1
CS(=O)(=O)n1c(cc2ccccc12)-c1ccc(OCCCN2CCCCC2)cc1
Cc1cccc2cc(cn12)-c1ccc(OCCCN2CCCCC2)cc1
CCc1c(cn2ccccc12)-c1ccc(OCCCN2CCCCC2)cc1
Cc1cc(OCCCN2CCCCC2)ccc1-c1cc2ccccn2c1
C(COc1ccc(cc1)-c1cc2ccccn2c1)CN1CCCCC1
CCc1c(cc2ccccn12)-c1ccc(OCCCN2CCCCC2)cc1
C(COc1ccc(cc1)-c1cn2ccccc2c1-c1ccccc1)CN1CCCCC1
Cc1ccn2cc(cc2c1)-c1ccc(OCCCN2CCCCC2)cc1
C(CNc1c2CCCCCc2nc2ccccc12)CN1CCCC1
CN1CCCC1CCNc1c2CCCCCc2nc2ccccc12
CN(C)CCCNc1c2CCCCCc2nc2ccccc12
C(CN1CCCCC1)C#Cc1c2CCCCCc2nc2ccccc12
C[C@H]1CCCN1CCCOc1ccc(cc1)C(\CN1CCCCC1=O)=N\OC(C)(C)C |r|
O=c1cccnn1-c1ccc2nc(sc2c1)N1CC[C@H](C1)N1CCCCC1 |r|
CC(C)N1CCCN(CC1)C(=O)C1CCN(CC1)c1ccc(nc1)C(F)(F)F
Cc1c[nH]c(=O)n(Cc2ccc(OCCCN3CCCCC3)cc2)c1=O
O=c1cc[nH]c(=O)n1Cc1ccc(OCCCN2CCCCC2)cc1
Cc1c(C)c(=O)[nH]c(=O)n1Cc1ccc(OCCCN2CCCCC2)cc1
Cc1cn(Cc2ccc(OCCCN3CCCCC3)cc2)c(=O)[nH]c1=O
O=c1ccn(Cc2ccc(OCCCN3CCCCC3)cc2)c(=O)[nH]1
O=c1ccn(CCCN2CCCCC2)c(=O)[nH]1
Cc1c(C)c(=O)n(Cc2ccc(OCCCN3CCCCC3)cc2)c(=O)n1C(=O)OC(C)(C)C
Cc1cn(C(=O)OC(C)(C)C)c(=O)n(Cc2ccc(OCCCN3CCCCC3)cc2)c1=O
CC(C)(C)OC(=O)n1ccc(=O)n(Cc2ccc(OCCCN3CCCCC3)cc2)c1=O
Cc1c(C)c(=O)n(C(=O)c2ccccc2)c(=O)n1Cc1ccc(OCCCN2CCCCC2)cc1
Cc1cn(Cc2ccc(OCCCN3CCCCC3)cc2)c(=O)n(C(=O)c2ccccc2)c1=O
O=C(c1ccccc1)n1c(=O)ccn(Cc2ccc(OCCCN3CCCCC3)cc2)c1=O
O=C(c1ccccc1)n1c(=O)ccn(CCCN2CCCCC2)c1=O
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(n3)-c3ccncc3)c(F)c2)CC1
CC(C)OCc1nc(no1)-c1ccc(OCCCN2CCCN(CC2)C(=O)[C@@H](C)NC(=O)c2ccco2)cc1F
C[C@@H](NC(=O)c1ccc(Br)cc1)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)C(C)(C)C)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccccc1)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)-c3ccccc3)c(F)c2)CC1
CC(C)C(=O)N[C@H](C)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)-c3ccccc3)c(F)c2)CC1
C[C@@H](NC(=O)c1cccc(Cl)c1)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(CC4CCCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(n3)C3CCCCCC3)c(F)c2)CC1
CC(C)CCC(=O)N[C@H](C)C(=O)N1CCCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
CCC(CC)c1nc(no1)-c1ccc(OCCCN2CCCN(CC2)C(=O)[C@@H](C)NC(=O)c2ccco2)cc1F
C[C@@H](NC(=O)c1ccsc1)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)-c3ccccc3)c(F)c2)CC1
CC(C)C(=O)N[C@H](C)C(=O)N1CCCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1cccc(OC(F)(F)F)c1)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
CC(C)CCC(=O)N[C@H](C)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)-c3ccccc3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccccc1Cl)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1cccc(c1)C(F)(F)F)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)CC(C)(C)C)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccc(cc1)C#N)C(=O)N1CCCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(n3)-c3ccccc3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccc(cc1)C#N)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
CC(C)C(NC(=O)OC(C)(C)C)c1nc(no1)-c1ccc(OCCCN2CCCN(CC2)C(=O)[C@@H](C)NC(=O)c2ccco2)cc1F
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(n3)C3CC3)c(F)c2)CC1
CC(C)C(=O)N[C@H](C)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(n3)C3CCCO3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccc(cc1)N(C)C)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(C)=O)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(n3)C3CCCC3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccc(Cl)c(Cl)c1)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
CCOCC(=O)N[C@H](C)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)-c3ccccc3)c(F)c2)CC1
CCc1nc(no1)-c1ccc(OCCCN2CCCN(CC2)C(=O)[C@@H](C)NC(=O)c2ccco2)cc1F
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(n3)-c3ccco3)c(F)c2)CC1
CCCCC(=O)N[C@H](C)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)CCN1CCOCC1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(n3)C(C)(C)C)c(F)c2)CC1
CC(C)CCC(=O)N[C@H](C)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
COc1ccc(cc1)C(=O)N[C@H](C)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(CCc4ccccc4)n3)c(F)c2)CC1
COc1ccccc1C(=O)N[C@H](C)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
CC(C)Cc1nc(no1)-c1ccc(OCCCN2CCCN(CC2)C(=O)[C@@H](C)NC(=O)c2ccco2)cc1F
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(n3)-c3ccsc3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(n3)C3CCCCC3)c(F)c2)CC1
CC(C)CC(=O)N[C@H](C)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccccc1C)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1cccc(c1)C#N)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(n3)[C@H](C)NC(=O)OC(C)(C)C)c(F)c2)CC1
CCC(=O)N[C@H](C)C(=O)N1CCCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1cccc(c1)N(C)C)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
COc1ccc(cc1)C(=O)N[C@H](C)C(=O)N1CCCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1cnccn1)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)-c3ccccc3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccccc1F)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(n3)[C@@H](C)NC(=O)OC(C)(C)C)c(F)c2)CC1
C[C@@H](NC(=O)c1cc(C)ccc1C)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
CCCCC(=O)N[C@H](C)C(=O)N1CCCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](N)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
C[C@@H](NC(=O)CCN1CCOCC1)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccc(Cl)c(Cl)c1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccno1)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)-c3ccccc3)c(F)c2)CC1
C[C@@H](NC(=O)CCN1CCOCC1)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)-c3ccccc3)c(F)c2)CC1
C[C@@H](NC(=O)CC(C)(C)C)C(=O)N1CCCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccc(cc1)C#N)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)-c3ccccc3)c(F)c2)CC1
C[C@@H](NC(=O)C1CCCC1)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)-c3ccccc3)c(F)c2)CC1
C[C@@H](NC(=O)c1cccc(F)c1)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](N)C(=O)N1CCCN(CCCOc2ccc(-c3noc(n3)C3CC3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)[C@H]1CCCO1)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)-c3ccccc3)c(F)c2)CC1
C[C@@H](NC(=O)[C@@H]1CCCO1)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)-c3ccccc3)c(F)c2)CC1
COc1ccc(cc1OC)C(=O)N[C@H](C)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1cccnc1)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)-c3ccccc3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
COc1cccc(c1)C(=O)N[C@H](C)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(n3)-c3cncs3)c(F)c2)CC1
CCC(=O)N[C@H](C)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(CC(C)(C)C)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(n3)-c3cccnc3)c(F)c2)CC1
C[C@@H](NC(=O)c1cccnc1)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(n3)-c3ccoc3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](N)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)C3CC3)c(F)c2)CC1
CC(C)CC(=O)N[C@H](C)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)-c3ccccc3)c(F)c2)CC1
C[C@@H](NC(=O)C(C)(C)C)C(=O)N1CCCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)CN1CCOCC1)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)-c3ccccc3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccc(C)cc1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
CC(C)c1nc(no1)-c1ccc(OCCCN2CCCN(CC2)C(=O)[C@@H](C)NC(=O)c2ccco2)cc1F
C[C@@H](NC(=O)c1ccc(O)cc1)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)C3CC3)c(F)c2)CC1
C[C@@H](NC(C)=O)C(=O)N1CCCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(Cc4ccccc4)n3)c(F)c2)CC1
C[C@@H](NC(=O)CC1CCCC1)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)-c3ccccc3)c(F)c2)CC1
CC(C)CCc1nc(no1)-c1ccc(OCCCN2CCCN(CC2)C(=O)[C@@H](C)NC(=O)c2ccco2)cc1F
C[C@@H](NC(=O)c1cccs1)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)-c3ccccc3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCCN(CCCOc2ccc(-c3noc(n3)-c3cccs3)c(F)c2)CC1
C[C@@H](NC(=O)c1ccco1)C(=O)N1CCN(CCCOc2ccc(C(=O)C3CC3)c(F)c2)CC1
C[C@@H](NC(=O)C1CCCCC1)C(=O)N1CCN(CCCOc2ccc(-c3noc(n3)-c3ccccc3)c(F)c2)CC1
CC(C)CC(=O)N[C@H](C)C(=O)N1CCCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
C[C@@H](NC(=O)c1cccc(C)c1)C(=O)N1CCN(CCCOc2ccc(-c3noc(CC4CCCC4)n3)c(F)c2)CC1
N#Cc1ccc(cc1)-c1ccc2oc(CCn3ccnc3)cc2c1
N#Cc1ccc(cc1)-c1ccc2oc(CCN3CCCC3)cc2c1
OC1CCN(CCc2cc3cc(ccc3o2)-c2ccc(cn2)C(=O)N2CCOCC2)C1
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cn1)C(=O)N1CCOCC1
OC1CCN(CCc2cc3cc(ccc3o2)-c2ccc(cc2)C#N)C1
O=C(N1CCOCC1)c1ccc(nc1)-c1ccc2oc(CCN3CCOCC3)cc2c1
C[C@H]1CCC[C@@H](C)N1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C(=O)N1CCOCC1
C[C@@H]1CC[C@@H](C)N1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C(=O)N1CCOCC1
N#Cc1ccc(cc1)-c1ccc2oc(CCN3CCCCC3)cc2c1
OC[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N
O=C(N1CCOCC1)c1ccc(cc1)-c1ccc2oc(CCN3CCCCCC3)cc2c1
OC[C@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cn1)C(=O)N1CCOCC1
CC1CCN(CCc2cc3cc(ccc3o2)-c2ccc(cn2)C(=O)N2CCOCC2)CC1
O=C(N1CCOCC1)c1ccc(cc1)-c1ccc2oc(CCN3CCCCC3)cc2c1
C[C@@H]1CC[C@@H](C)N1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N
OC[C@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N
CC1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N
O=C(N1CCOCC1)c1ccc(nc1)-c1ccc2oc(CCN3CCCC3)cc2c1
CC1CCN(CCc2cc3cc(ccc3o2)-c2ccc(cc2)C#N)CC1
OC(=O)C[C@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N
CC1CCCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N
N#Cc1ccc(cc1)-c1ccc2oc(CCN3CCC=CC3)cc2c1 |c:20|
O=C(N1CCOCC1)c1ccc(cc1)-c1ccc2oc(CCN3CCC=CC3)cc2c1 |c:27|
CN(C)[C@@H]1CCN(CCc2cc3cc(ccc3o2)-c2ccc(cc2)C#N)C1
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C(=O)N1CCOCC1
O=C(N1CCOCC1)c1ccc(nc1)-c1ccc2oc(CCN3CCCCC3)cc2c1
CC1CCCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C(=O)N1CCOCC1
CN(C)[C@H]1CCN(CCc2cc3cc(ccc3o2)-c2ccc(cc2)C#N)C1
CC1CCN(CCc2cc3cc(ccc3o2)-c2ccc(cc2)C(=O)N2CCOCC2)CC1
N#Cc1ccc(cc1)-c1ccc2oc(CCN3CCCCCC3)cc2c1
O=C(N1CCOCC1)c1ccc(nc1)-c1ccc2oc(CCN3CCCCCC3)cc2c1
C[C@H]1CCC[C@@H](C)N1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N
OC[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C(=O)N1CCOCC1
O=C(N1CCOCC1)c1ccc(cc1)-c1ccc2oc(CCN3CCOCC3)cc2c1
C[C@H]1CCC[C@@H](C)N1CCc1cc2cc(ccc2o1)-c1ccc(cn1)C(=O)N1CCOCC1
C[C@@H]1CC[C@@H](C)N1CCc1cc2cc(ccc2o1)-c1ccc(cn1)C(=O)N1CCOCC1
Fc1ccc(cc1)C(=O)CCCOCCCc1cnc[nH]1
C(CC1CCCCC1)OCc1cnc[nH]1
C=CCOCCCc1cnc[nH]1
C#CCOCCCc1cnc[nH]1
CCCCCCOCCCc1cnc[nH]1
O=C(COCCCc1cnc[nH]1)c1ccccc1
C(COCC(Cc1ccccc1)c1ccccc1)Cc1cnc[nH]1
COCCCc1cnc[nH]1
CCOCCCc1cnc[nH]1
C(OCc1cnc[nH]1)C1CCCCC1
CCCCCOCCCc1cnc[nH]1
C#CCCCOCCCc1cnc[nH]1
CC(C)(C)OCCCc1cnc[nH]1
C(COCCCc1cnc[nH]1)CC1CCCCC1
C=CCCCOCCCc1cnc[nH]1
[O-][N+](=O)c1cccc(c1)C(=O)COCCCc1cnc[nH]1
CC(C)(C)OCCc1cnc[nH]1
CCCCOCCCc1cnc[nH]1
C(COCCC1CCCCC1)Cc1cnc[nH]1
C(COCC1CC1)Cc1cnc[nH]1
CCCCCCCOCCCc1cnc[nH]1
C(COC(c1ccccc1)(c1ccccc1)c1ccccc1)Cc1cnc[nH]1
C(COCCCc1cnc[nH]1)CC1CCCC1
N#CCCOCCCc1cnc[nH]1
CCCOCCCc1cnc[nH]1
CC(=O)CCOCCCc1cnc[nH]1
FC(F)(F)c1cccc(SCCCc2cnc[nH]2)c1
FC(F)(F)c1cccc(SCCc2cnc[nH]2)c1
Cc1cccc(OCCCc2cnc[nH]2)c1
FC(F)(F)c1cccc(OCCc2cnc[nH]2)c1
Brc1cccc(OCCCc2cnc[nH]2)c1
FC(F)(F)c1cccc(CCCCc2cnc[nH]2)c1
[O-][N+](=O)c1cccc(OCCCc2cnc[nH]2)c1
N#Cc1cccc(OCCCc2cnc[nH]2)c1
CCc1cccc(OCCCc2cnc[nH]2)c1
FC(F)(F)c1cccc(OCCCc2cnc[nH]2)c1
FC(F)(F)c1cc(OCCCc2cnc[nH]2)cc(c1)C(F)(F)F
CC(C)c1cccc(OCCCc2cnc[nH]2)c1
CC(C)(C)c1cccc(OCCCc2cnc[nH]2)c1
C(COc1ccc2N=C3CCCN3Cc2c1)CN1CCCCC1 |t:7|
CC(C)N1CCN(CC1)c1ccc2ccccc2n1
C1CCN2CCN(C[C@H]2C1)c1ccc2ccccc2n1
FC(F)(F)c1ccc2nc(ccc2c1)N1CCN(CC1)C1CC1
C1CC1N1CCN(CC1)c1ccc2cc(ccc2n1)-n1cccn1
CN1CCN(CC1)c1ccc2ccccc2n1
Fc1ccc(cc1)C(=O)c1ccc2nc(ccc2c1)N1CCN(CC1)C1CC1
CCC(CC)N1CCN(CC1)c1ccc2ccccc2n1
C1CC1N1CCN(CC1)c1ccc2ccccc2n1
CCC(CC)N1CCN(CC1)C(=O)CCC(=O)c1ccc(OC)c(OC)c1
C1CCC(C1)N1CCN(CC1)c1ccc2ccccc2n1
O=C(C1CC1)c1ccc2nc(ccc2c1)N1CCN(CC1)C1CC1
CN1CCN(CC1)C2=Nc3cc(ccc3Nc4c2cccc4)Cl
Clc1ccc2ccc(nc2c1)N1CCN(CC1)C1CC1
CCN1CCN(CC1)c1ccc2ccccc2n1
Clc1cc(Cl)c2ccc(nc2c1)N1CCN(CC1)C1CC1
N#Cc1ccc2nc(ccc2c1)N1CCN(CC1)C1CC1
Clc1ccc2nc(ccc2c1)N1CCN(CC1)C1CC1
COc1ccc2nc(ccc2c1)N1CCN(CC1)C1CC1
C1CC1N1CCN(CC1)c1ccc2cc(ccc2n1)C1CCCCC1
CN(C)[C@@H]1C[C@@H](c2ccccc2)c2ccccc2C1 |r|
CN(C)[C@H]1C[C@H](c2ccccc2)c2ccccc2C1 |r|
CN(C)[C@@H]1C[C@@H](c2cccc(F)c2)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2cccc(F)c2)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2cccc(Cl)c2)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2cccc(Cl)c2)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2cccc(Br)c2)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2cccc(Br)c2)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2cccc(c2)C(F)(F)F)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2cccc(c2)C(F)(F)F)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2cccc(c2)[N+]([O-])=O)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2cccc(c2)[N+]([O-])=O)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2ccc(F)cc2)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2ccc(F)cc2)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2ccc(Cl)cc2)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2ccc(Cl)cc2)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2ccc(Br)cc2)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2ccc(Br)cc2)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2ccc(cc2)C(F)(F)F)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2ccc(cc2)C(F)(F)F)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2ccc(cc2)[N+]([O-])=O)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2ccccc2Br)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2ccccc2Br)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](C2CCCCC2)c2ccccc2C1
CN(C)[C@H]1C[C@H](C2CCCCC2)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](C2CCCCCCC2)c2ccccc2C1
CN(C)[C@H]1C[C@H](C2CCCCCCC2)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2cccc(c2)-c2ccccc2)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2cccc(c2)-c2ccccc2)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2ccccc2Cl)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2ccccc2Cl)c2ccccc2C1
CN(C)[C@@H]1C[C@@H](c2ccccc2C)c2ccccc2C1
CN(C)[C@H]1C[C@H](c2ccccc2C)c2ccccc2C1
C[C@@H]1CCCN1CCc1cc2cc(CNc3cccc(c3)C#N)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(CNc3cncnc3)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(Nc3ccc(cc3)C#N)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(CNc3cc(nc(c3)C#N)C#N)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(CNc3ncc(s3)[N+]([O-])=O)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(Nc3ccc(cn3)C(F)(F)F)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(Nc3nc(C)ccc3C#N)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(Nc3ccccc3[N+]([O-])=O)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(Nc3ccc(cn3)[N+]([O-])=O)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(Nc3cnccn3)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(CNc3nccnc3C#N)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(CNc3ccc(Cl)nn3)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(CNc3cnccn3)ccc2o1
CCc1cnc(NCc2ccc3oc(CCN4CCC[C@H]4C)cc3c2)nc1
C[C@@H]1CCCN1CCc1cc2cc(CNc3ncccn3)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(Nc3cncnc3)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(CNc3ncccc3C#N)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(CNc3ccccc3[N+]([O-])=O)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(CNc3ccc(cn3)[N+]([O-])=O)ccc2o1
CCc1cnc(Nc2ccc3oc(CCN4CCC[C@H]4C)cc3c2)nc1
C[C@@H]1CCCN1CCc1cc2cc(CNc3ncc(Br)cn3)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(CNc3ncc(cc3[N+]([O-])=O)[N+]([O-])=O)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(Nc3cccc(c3)C#N)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(CNc3ccc(cc3)C(=O)C(F)(F)F)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(Nc3ncccn3)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(CNc3ccc(cc3)[N+]([O-])=O)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(Nc3ncccc3[N+]([O-])=O)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(CNc3ccc(cn3)C#N)ccc2o1
C[C@@H]1CCCN1CCc1cc2cc(CNc3ncccc3[N+]([O-])=O)ccc2o1
O=S(=O)(CCCN1CCC(Cc2cnc[nH]2)CC1)c1ccccc1
CCCCCCCN1CCC(Cc2cnc[nH]2)CC1
Fc1cccc(NC(=O)CCN2CCC(Cc3cnc[nH]3)CC2)c1
O=C(CCN1CCC(Cc2cnc[nH]2)CC1)NC1CCCCC1
COc1ccc(NC(=O)CCN2CCC(Cc3cnc[nH]3)CC2)cc1
COC(=O)c1ccc(NC(=O)CCN2CCC(Cc3cnc[nH]3)CC2)cc1
O=C(CCCc1ccccc1)N1CCC(Cc2cnc[nH]2)CC1
Clc1cccc(NC(=O)CC(=O)N2CCC(Cc3cnc[nH]3)CC2)c1
Clc1cccc(NCCCN2CCC(Cc3cnc[nH]3)CC2)c1
O=C(CCOc1ccccc1)N1CCC(Cc2cnc[nH]2)CC1
C(COc1ccccc1)CN1CCC(Cc2cnc[nH]2)CC1
C(CCc1ccccc1)CN1CCC(Cc2cnc[nH]2)CC1
Clc1ccc(NC(=O)N2CCC(Cc3cnc[nH]3)CC2)cc1
Clc1ccc(NC(=O)CCC(=O)N2CCC(Cc3cnc[nH]3)CC2)cc1
CN(C(=O)CCN1CCC(Cc2cnc[nH]2)CC1)c1ccc(Cl)cc1
Clc1cccc(NC(=O)CCN2CCC(Cc3cnc[nH]3)CC2)c1
Clc1ccc(NC(=O)CCCN2CCC(Cc3cnc[nH]3)CC2)cc1
Clc1ccc(cc1)C(=O)NCCCN1CCC(Cc2cnc[nH]2)CC1
Clc1cccc(OCCCN2CCC(Cc3cnc[nH]3)CC2)c1
Clc1ccc(CNC(=O)CCN2CCC(Cc3cnc[nH]3)CC2)cc1
O=NCc1ccc(OCCCN2CCC(Cc3cnc[nH]3)CC2)cc1
Clc1ccc(NC(=O)CN2CCC(Cc3cnc[nH]3)CC2)cc1
COC(=O)c1ccc(OCCC(=O)N2CCC(Cc3cnc[nH]3)CC2)cc1
Clc1ccc(NS(=O)(=O)CCN2CCC(Cc3cnc[nH]3)CC2)cc1
O=C(CCN1CCC(Cc2cnc[nH]2)CC1)Nc1ccccc1
N#Cc1ccc(OCCCN2CCC(Cc3cnc[nH]3)CC2)cc1
Clc1ccc(NC(=O)CCN2CCC(Cc3cnc[nH]3)CC2)cc1
CCCCCCC(=O)N1CCC(Cc2cnc[nH]2)CC1
Clc1ccc(cc1)C(=O)NCCN1CCC(Cc2cnc[nH]2)CC1
Clc1ccc(CCCCN2CCC(Cc3cnc[nH]3)CC2)cc1
Clc1ccc(NC(=O)CCCCN2CCC(Cc3cnc[nH]3)CC2)cc1
[H][C@@]12C[C@]1([H])C(=NNC2=O)c1ccc(OCCCN2CCC[C@H]2C)cc1 |r,c:6|
[H][C@]12C[C@@]1([H])C(=NNC2=O)c1ccc(OCCCN2CCC[C@H]2C)cc1 |r,c:6|
Cc1cc(OCCCN2CCCCC2)ccc1C1=NNC(=O)C2CC12 |t:19|
C[C@H]1CCCN1CCCOc1ccc(C2=NNC(=O)C3CC23)c(C)c1 |r,t:15|
C[C@@H]1CCCN1CCCOc1ccc(C2=NNC(=O)C3CC23)c(C)c1 |r,t:15|
O=C1NN=C(C2CC12)c1ccc(OCCCN2CCCCC2)cc1 |c:3|
C[C@H]1CCCN1CCCOc1ccc(cc1)C1=NNC(=O)C2CC12 |r,t:18|
C[C@H](COc1ccc(cc1)C1=NNC(=O)C2CC12)CN1CCC[C@H]1C |r,t:11|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C1=NNC(=O)C2CC12 |r,t:18|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1ccc(=O)[nH]n1 |r|
C(COc1ccc(cc1)-c1ncccn1)CN1CCC(Cc2cnc[nH]2)CC1
O=C(N1CCNCC1)c1ccc(OCCCN2CCC(Cc3cnc[nH]3)CC2)cc1
C(COc1ccc(NC2CCCCC2)cc1)CN1CCC(Cc2cnc[nH]2)CC1
CN(C)CCCOc1ccc(CCCN2CCC(Cc3cnc[nH]3)CC2)cc1
C(COc1ccc(OC2CCCCC2)cc1)CN1CCC(Cc2cnc[nH]2)CC1
CCN(CC)Cc1ccc(OCCCN2CCC(Cc3cnc[nH]3)CC2)cc1
C(COc1ccc(CN2CCC(CC2)N2CCCCC2)cc1)CN1CCC(Cc2cnc[nH]2)CC1
C(COc1ccc2ncccc2c1)CN1CCC(Cc2cnc[nH]2)CC1
C(CN1CCC(Cc2cnc[nH]2)CC1)Oc1ccc(CN2CCCCC2)cc1
O=C(N1CCCCC1)c1ccc(OCCCN2CCC(Cc3cnc[nH]3)CC2)cc1
C(COc1ccc(cc1)-c1cccnc1)CN1CCC(Cc2cnc[nH]2)CC1
CN(C)CCCOc1ccc(CN2CCCCC2)cc1
NC(=O)C1CCN(Cc2ccc(OCCCN3CCC(Cc4cnc[nH]4)CC3)cc2)CC1
CN(C)CCCOc1ccc(CN2CCC(Cc3cnc[nH]3)CC2)cc1
O=C(CCOc1ccc(cc1)C(=O)N1CCNCC1)N1CCC(Cc2cnc[nH]2)CC1
O=C(CCc1ccc(CN2CCCCC2)cc1)N1CCC(Cc2cnc[nH]2)CC1
O=C1CCCCN1Cc1ccc(OCCCN2CCC(Cc3cnc[nH]3)CC2)cc1
C(COc1cccc(CN2CCCCC2)c1)CN1CCC(Cc2cnc[nH]2)CC1
C(COc1ccc(cc1)N1CCCCC1)CN1CCC(Cc2cnc[nH]2)CC1
C(COc1ccc(CN2CCCCC2)cc1)CN1CCC(Cc2cnc[nH]2)CC1
C(COc1ccc(cc1)N1CCNCC1)CN1CCC(Cc2cnc[nH]2)CC1
O=C(CCN1CCC(Cc2cnc[nH]2)CC1)Nc1ccc(CN2CCCCC2)cc1
O=C(Nc1nccs1)N1CCC(Cc2cnc[nH]2)CC1
C(CCN1CCC(Cc2cnc[nH]2)CC1)COc1ccc(CN2CCCCC2)cc1
C(COc1ccc(CN2CCCCC2)nc1)CN1CCC(Cc2cnc[nH]2)CC1
C(COc1cccc(OC2CCCCC2)c1)CN1CCC(Cc2cnc[nH]2)CC1
FC1(F)CCN(Cc2ccc(OCCCN3CCC(Cc4cnc[nH]4)CC3)cc2)CC1
Nc1ncc(cn1)-c1ccc(OCCCN2CCC(Cc3cnc[nH]3)CC2)cc1
O=C(CCOc1ccc(CN2CCCCC2)cc1)N1CCC(Cc2cnc[nH]2)CC1
C(COc1ccc(cc1)-c1cncnc1)CN1CCC(Cc2cnc[nH]2)CC1
O=C(Nc1ncccn1)N1CCC(Cc2cnc[nH]2)CC1
O=C(N1CCCCC1)c1ccc(OCCCN2CCC(Cc3cnc[nH]3)CC2)nc1
C(COc1ccc(CCN2CCCCC2)cc1)CN1CCC(Cc2cnc[nH]2)CC1
Brc1cc(CN2CCCCC2)cc(Br)c1OCCCN1CCCCC1
CN(C)CCCOc1c(Br)cc(CN(C)C)cc1Br
CN(C)CCCOc1c(Br)cc(CCN(C)C)cc1Br
CN(C)CCOc1ccc(CCN(C)C)cc1
CN(C)CCc1ccc(OCCCN2CCCCC2)cc1
CN(C)CCCOc1ccc(CCN(C)C)cc1
CN(C)CCc1ccc(OCCN2CCCCC2)cc1
CN(C)CCCOc1ccc(CN(C)C)cc1
O=C(N1CCNCC1)c1cc2ccccc2[nH]1
CN1CCN(CC1)C(=O)c1nc2ccc(Cl)cc2[nH]1
COc1ccc2cccc(N3CCN(CCCCn4ncc(=O)n(C)c4=O)CC3)c2c1
N#Cc1n(CCCCCCN2CCCCC2)cc2ccccc12
[O-][N+](=O)c1ccc(NCCCCN2CCCCC2)c2nonc12
N#Cc1n(CCCN2CCCCC2)cc2ccccc12
N#Cc1n(CCCCCN2CCCCC2)cc2ccccc12
[O-][N+](=O)c1ccc(NCCCCCN2CCCCC2)c2nonc12
N#Cc1n(CCCCN2CCCCC2)cc2ccccc12
COc1cccc(c1)N1CCN(CCCCn2ncc(=O)n(C)c2=O)CC1
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(NC(=O)CCC(O)=O)cc1 |r|
COC(=O)C(C)(C)C(=O)Nc1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(cc1)C1(CCCC1)NC(=O)CCCC(O)=O |r|
COC(=O)CC(=O)NC1(CCCC1)c1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
COC(=O)CC(=O)NCCc1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
COC(=O)CCCC(=O)NC1(CCCC1)c1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
C[C@@H](C(=O)NCCc1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1)C(=O)OC(C)(C)C |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(CCNC(=O)C(C)(C)C(=O)OC(C)(C)C)cc1 |r|
FC1CCN(Cc2ccc(cc2)C(=O)N2CCN(CC2)C2CC2)CC1
FC1CCN(Cc2ccc(cc2)C(=O)N2CCN(CC2)C2CCC2)CC1
CC(C)N1CCN(CC1)C(=O)c1ccc(CN2CCC(F)CC2)cc1
Cl.O=C(N1CCN(CC1)C1CC1)c1ccc(CN2CCOCC2)cc1
O=C(N1CCN(CC1)C1CCC1)c1ccc(CN2CCOCC2)cc1
OC(=O)\C=C/C(O)=O.CC(C)N1CCN(CC1)C(=O)c1ccc(CN2CCOCC2)cc1
CC(C)N1CCN(CC1)C(=O)c1ccc(CN2CCCCC2)cc1
CC(C)N1CCN(CC1)C(=O)c1ccc(CN2CCCCCC2)cc1
CC(C)N1CCN(CC1)C(=O)c1ccc(CN2CCCC2)cc1
CCN(CC)Cc1ccc(cc1)C(=O)N1CCN(CC1)C(C)C
CC(C)N1CCN(CC1)C(=O)c1ccc(CN(C)C)cc1
CN1CCN(CC1)C(=O)c1ccc(CN2CCOCC2)cc1
CN1CCN(CC1)C(=O)c1ccc(CN2CCCCC2)cc1
FC(F)(F)c1ccc2oc(cc2c1)C(=O)N1CCC[C@H]1CN1CCCCC1
Clc1ccc2oc(cc2c1)C(=O)N1CCC[C@H]1CN1CCCC1
CCN(CC)C[C@@H]1CCCN1C(=O)c1cc2cc(ccc2o1)C(F)(F)F
O=C(N1CCC[C@H]1CN1CCCC1)c1cnc2ccccc2c1
CCN(CC)C[C@@H]1CCCN1C(=O)c1cc2ccc(cc2o1)C(F)(F)F
FC(F)(F)c1ccc2cc(oc2c1)C(=O)N1CCC[C@H]1CN1CCCCC1
O=C(N1CCC[C@H]1CN1CCCC1)c1cc2ccccc2s1
O=C(N1CCC[C@H]1CN1CCCCC1)c1cnc2ccccc2c1
FC(F)(F)c1ccc2cc(oc2c1)C(=O)N1CCC[C@H]1CN1CCCC1
Clc1c(sc2ccccc12)C(=O)N1CCC[C@H]1CN1CCCC1
O=C(N1CCC[C@H]1CN1CCCC1)c1cc2cc(ccc2o1)C#N
CCOc1cccc2cc(oc12)C(=O)N1CCC[C@H]1CN1CCCC1
FC(F)(F)c1ccc2oc(cc2c1)C(=O)N1CCC[C@H]1CN1CCCC1
FC(F)(F)Oc1ccc2oc(cc2c1)C(=O)N1CCC[C@H]1CN1CCCC1
C(COc1ccc2N(CC3CCCCC3)CCCc2c1)CN1CCCCC1
CCN1CCc2ccc(OCCCN3CCCCC3)cc2C1
CCN1CCCc2c(OCCCN3CCCCC3)cccc12
C(COc1ccc2CN(Cc3ccccc3)CCCc2c1)CN1CCCCC1
C(COc1ccc2NCCCc2c1)CN1CCCCC1
C(COc1cccc2CNCCc12)CN1CCCCC1
O=C(N1CCc2ccc(OCCCN3CCCCC3)cc2C1)c1cccs1
CS(=O)(=O)N1CCc2ccc(OCCCN3CCCCC3)cc2CC1
CC(=O)N1CCc2ccc(OCCCN3CCCCC3)cc2C1
CCN1CCc2c(C1)cccc2OCCCN1CCCCC1
CC(C)N1CCCc2cc(OCCCN3CCCCC3)ccc2C1
O=C(N1CCCc2ccc(OCCCN3CCCCC3)cc12)c1cccs1
O=C(N1CCc2cc(OCCCN3CCCCC3)ccc2C1)c1cccs1
O=C(N1CCc2cccc(OCCCN3CCCCC3)c2C1)c1cccs1
CCN1CCc2cc(OCCCN3CCCCC3)ccc2C1
O=S(=O)(N1CCc2cccc(OCCCN3CCCCC3)c2C1)c1ccccc1
CC(C)NC(=O)N1CCc2ccc(OCCCN3CCCCC3)cc2C1
C(COc1cccc2CN(CC3CCCCC3)CCc12)CN1CCCCC1
CC(C)NC(=O)N1CCc2ccc(OCCCN3CCCCC3)cc2CC1
O=S(=O)(N1CCCc2ccc(OCCCN3CCCCC3)cc12)c1ccccc1
CS(=O)(=O)N1CCc2ccc(OCCCN3CCCCC3)cc2C1
O=S(=O)(N1CCCc2cc(OCCCN3CCCCC3)ccc12)c1ccccc1
CCN1CCc2ccc(OCCCN3CCCCC3)cc2CC1
CC(C)N1CCc2ccc(OCCCN3CCCCC3)cc2C1
C(COc1ccc2CCN(CC3CCCCC3)Cc2c1)CN1CCCCC1
C(COc1cccc2CCCN(CC3CCCCC3)c12)CN1CCCCC1
C(COc1ccc2CCNCc2c1)CN1CCCCC1
CS(=O)(=O)N1CCCc2cc(OCCCN3CCCCC3)ccc2C1
CC(C)NC(=O)N1CCCc2cc(OCCCN3CCCCC3)ccc2C1
C(COc1ccc2CN(CC3CCCCC3)CCc2c1)CN1CCCCC1
O=S(=O)(N1CCc2c(C1)cccc2OCCCN1CCCCC1)c1ccccc1
CCN1CCCc2ccc(OCCCN3CCCCC3)cc12
CC(=O)N1CCc2ccc(OCCCN3CCCCC3)cc2CC1
O=S(=O)(N1CCCc2cccc(OCCCN3CCCCC3)c12)c1ccccc1
O=C(N1CCCc2cccc(OCCCN3CCCCC3)c12)c1cccs1
C(COc1cccc2CCCNc12)CN1CCCCC1
O=S(=O)(N1CCc2cc(OCCCN3CCCCC3)ccc2C1)c1ccccc1
C(COc1cccc2NCCCc12)CN1CCCCC1
CCN1CCc2cccc(OCCCN3CCCCC3)c2C1
CC(C)N1CCc2ccc(OCCCN3CCCCC3)cc2CC1
C(COc1ccc2CCN(CC3CCCCC3)CCc2c1)CN1CCCCC1
CCN1CCCc2cc(OCCCN3CCCCC3)ccc2C1
O=C(N1CCc2c(C1)cccc2OCCCN1CCCCC1)c1cccs1
C(COc1cccc2CCN(CC3CCCCC3)Cc12)CN1CCCCC1
CCN1CCCc2cc(OCCCN3CCCCC3)ccc12
C(COc1cccc2N(CC3CCCCC3)CCCc12)CN1CCCCC1
C(COc1ccc2CCCNc2c1)CN1CCCCC1
C(COc1cccc2CCNCc12)CN1CCCCC1
O=S(=O)(N1CCc2ccc(OCCCN3CCCCC3)cc2C1)c1ccccc1
CCN1CCCc2cccc(OCCCN3CCCCC3)c12
C(COc1ccc2CCCN(CC3CCCCC3)c2c1)CN1CCCCC1
Clc1ccc(CNC(=O)N2CCN(CC2)C2CCCC2)cc1Cl
CC(C)N1CCN(CC1)C(=O)N1CCC(CC1)C(C)(C)C
COc1ccc(CNC(=O)N2CCC[C@H]2CN2CCCC2)cc1
FC(F)(F)Oc1ccc(CNC(=O)N2CCC[C@H]2CN2CCCC2)cc1
Clc1ccc(\C=C\C(=O)N2CCC[C@H]2CN2CCCC2)cc1
CCN1CCN(CC1)C(=O)NC1Cc2ccccc2C1
COc1cccc(CNC(=O)N2CCC[C@H]2CN2CCCC2)c1
CC(C)N1CCN(CC1)C(=O)N1CCC(CC1)NC(=O)C1CCCC1
CC(C)N1CCN(CC1)C(=O)NCc1ccc(Oc2ccccc2)cc1
CC(C)N1CCN(CC1)C(=O)N1CCC(CC1)C(=O)OC(C)(C)C
CC(C)N1CCN(CC1)C(=O)NC1Cc2ccccc2C1
CN(Cc1ccc(cc1)-c1ccccc1)C(=O)N1CCC[C@H]1CN1CCCC1
O=C(NCCc1ccccc1)N1CCC[C@H]1CN1CCCC1
CC(C)N1CCN(CC1)C(=O)N1Cc2ccccc2C1
O=C(NCc1ccc(Oc2ccccc2)cc1)N1CCN(CC1)C1CCCC1
FC(F)(F)Oc1ccc(\C=C\C(=O)N2CCC[C@H]2CN2CCCC2)cc1
O=C(NCc1ccc(cc1)-c1ccccc1)N1CCC[C@H]1CN1CCCC1
Clc1ccc(CNC(=O)N2CCC[C@H]2CN2CCCC2)cc1
FC(F)(F)c1ccc(CNC(=O)N2CCC[C@H]2CN2CCCC2)cc1
CC(C)N1CCN(CC1)C(=O)N1CCC(CC1)C(=O)N1CC2CCC(CC2)C1 |(-10.27,-12.49,;-8.93,-13.25,;-8.92,-14.79,;-7.6,-12.47,;-7.61,-10.93,;-6.29,-10.15,;-4.94,-10.9,;-4.93,-12.44,;-6.26,-13.23,;-3.62,-10.12,;-3.64,-8.58,;-2.28,-10.87,;-2.27,-12.41,;-.93,-13.16,;.4,-12.38,;.38,-10.84,;-.96,-10.08,;1.74,-13.14,;1.75,-14.68,;3.07,-12.37,;4.64,-12.83,;5.99,-11.86,;7.33,-12.56,;6.6,-11.37,;4.98,-10.51,;5.01,-9.04,;6.04,-10.28,;4.29,-11.83,)|
O=C(NCc1ccccc1)N1CCC[C@H]1CN1CCCC1
CCN1CCN(CC1)C(=O)N[C@@H]1C[C@H]1c1ccccc1
NCc1ccc(CNC(=O)N2CCC[C@H]2CN2CCCC2)cc1
O=C(NCc1ccc(Oc2ccccc2)cc1)N1CCC[C@H]1CN1CCCC1
CC(C)N1CCN(CC1)C(=O)N1CCC(=CC1)c1ccccc1 |c:15|
O=C(N1Cc2ccccc2C1)N1CCN(CC1)C1CC1
CC(C)N1CCN(CC1)C(=O)N1CCC(CC1)c1ccccc1
FC(F)(F)c1ccc(\C=C\C(=O)N2CCC[C@H]2CN2CCCC2)cc1 |r|
O=C(NC1Cc2ccccc2C1)N1CCN(CC1)C1CCCC1
O=C(N1Cc2ccccc2C1)N1CCC[C@H]1CN1CCCC1
CC(C)N1CCN(CC1)C(=O)NCc1ccc(Cl)c(Cl)c1
FC(F)(F)c1cccc(CNC(=O)N2CCC[C@H]2CN2CCCC2)c1
O=C(\C=C\c1ccc(cc1)-c1ccccc1)N1CCC[C@H]1CN1CCCC1
Clc1ccc(CNC(=O)N2CCC[C@H]2CN2CCCC2)cc1Cl
O=C(NCC1CCCCC1)N1CCC[C@H]1CN1CCCC1
CC(C)N1CCN(CC1)C(=O)N(C)Cc1ccc(cc1)-c1ccccc1
CC(C)N1CCN(CC1)C(=O)N1CCc2ccccc2C1
O=C(N1Cc2ccccc2C1)N1CCN(CC1)C1CCCC1
COc1cc2CCN(Cc2cc1OC)C(=O)N1CCN(CC1)C(C)C
CC(C)N1CCN(CC1)C(=O)N1CCC(Cc2ccccc2)CC1
NCc1cccc(CNC(=O)N2CCC[C@H]2CN2CCCC2)c1
O=C(NC1Cc2ccccc2C1)N1CCC[C@H]1CN1CCCC1
O=C(NCc1ccccc1)N1CCN(CC1)C1CCCC1
C(C[C@H]1C[C@@H]1c1cnc[nH]1)NCC1CCCCC1
Clc1ccc(CNCC[C@H]2C[C@H]2c2cnc[nH]2)cc1
C(C[C@@H]1C[C@H]1c1cnc[nH]1)NCC1CCCCC1
Clc1ccc(CNC[C@@H]2C[C@H]2c2cnc[nH]2)cc1
C(NCC1CCCCC1)[C@@H]1C[C@H]1c1cnc[nH]1
C(C[C@@H]1C[C@@H]1c1cnc[nH]1)NCC1CCCCC1
Clc1ccc(CNCC[C@H]2C[C@@H]2c2cnc[nH]2)cc1
C(NCC1CCCCC1)[C@H]1C[C@H]1c1cnc[nH]1
Clc1ccc(CNC[C@H]2C[C@@H]2c2cnc[nH]2)cc1
Clc1ccc(CNCC[C@@H]2C[C@H]2c2cnc[nH]2)cc1
C(C[C@H]1C[C@H]1c1cnc[nH]1)NCC1CCCCC1
C(NCC1CCCCC1)[C@@H]1C[C@@H]1c1cnc[nH]1
Clc1ccc(CNC[C@H]2C[C@H]2c2cnc[nH]2)cc1
C(NCC1CCCCC1)[C@H]1C[C@@H]1c1cnc[nH]1
Clc1ccc(CNCC[C@@H]2C[C@@H]2c2cnc[nH]2)cc1
Clc1ccc(CNC[C@@H]2C[C@@H]2c2cnc[nH]2)cc1
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCN(CC3)C(C)C)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCNC3CC3)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCN(CC3)c3ccc(cc3)C#N)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCS(=O)(=O)CC3)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCOCC3)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCN(CC3)c3ccccc3O)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCC(F)CC3)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCN(CC3)C(=O)C(C)C)ccc12 |w:8.8|
CCN(CC)CCCOc1ccc2C(CN(C)Cc2c1)c1ccc(OC)cc1 |w:13.21|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCN(CC3)c3ccc(cc3)C(F)(F)F)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCC(CO)CC3)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CC(F)(F)C3)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCN(CC3)C(=O)c3ccncc3)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCN(CC3)c3nccs3)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCN(CC3)c3ccncc3)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCC(F)(F)C3)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCN(CC3)C(C)=O)ccc12 |w:8.8|
CCN1CCN(CCCOc2ccc3C(CN(C)Cc3c2)c2ccc(OC)cc2)CC1 |w:14.22|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCCC(F)(F)C3)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCC3)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCC(F)(F)CC3)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCC(O)CC3)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCC(CC3)C#N)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN(C3CC3)C3CC3)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCC(CC3)C(F)(F)F)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCN(CC3)C(=O)c3cccn3C)ccc12 |w:8.8|
CCNCCCOc1ccc2C(CN(C)Cc2c1)c1ccc(OC)cc1 |w:11.19|
CNCC[C@H](c1ccccc1)Oc2ccc(cc2)C(F)(F)F
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCN(CC3)C3CC3)ccc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCCCC3)ccc12 |w:8.8|
CN1CC(c2ccccc2Cl)c2ccc(OCCCN3CCC(F)CC3)cc2C1 |w:3.3|
CN1CC(c2ccccc2)c2ccc(OCCCN3CCC(F)CC3)cc2C1 |w:3.3|
CSc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCOCC3)ccc12 |w:8.8|
CN1CC(c2ccc(cc2)S(C)(=O)=O)c2ccc(OCCCN3CCC(F)CC3)cc2C1 |w:3.3|
COc1cccc(c1)C1CN(C)Cc2cc(OCCCN3CCC(F)CC3)ccc12 |w:8.8|
CSc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCC(F)CC3)ccc12 |w:8.8|
CCOc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCC(F)CC3)ccc12 |w:9.9|
CN1CC(c2cccc(c2)C(F)(F)F)c2ccc(OCCCN3CCC(F)CC3)cc2C1 |w:3.3|
CN1CC(c2ccc(OC(F)F)cc2)c2ccc(OCCCN3CCC(F)CC3)cc2C1 |w:3.3|
COc1ccc(cc1Cl)C1CN(C)Cc2cc(OCCCN3CCC(F)CC3)ccc12 |w:9.9|
CN1CC(c2ccc(cc2)C#N)c2ccc(OCCCN3CCC(F)CC3)cc2C1 |w:3.3|
COc1ccc(cc1)[C@@H]1CN(C)Cc2cc(OCCCN3CCOC[C@@H]3C)ccc12
CN1CC(c2ccc(C)cc2)c2ccc(OCCCN3CCC(F)CC3)cc2C1 |w:3.3|
CN1CC(c2ccc(Cl)cc2)c2ccc(OCCCN3CCC(F)CC3)cc2C1 |w:3.3|
COc1ccc(cc1)[C@H]1CN(C)Cc2cc(OCCCN3CCOC[C@@H]3C)ccc12
CN1CC(c2ccc(cc2)C(F)(F)F)c2ccc(OCCCN3CCC(F)CC3)cc2C1 |w:3.3|
CN1CC(c2ccc(SC(F)(F)F)cc2)c2ccc(OCCCN3CCC(F)CC3)cc2C1 |w:3.3|
CN1CC(c2cccc(Cl)c2)c2ccc(OCCCN3CCC(F)CC3)cc2C1 |w:3.3|
CN1CC(c2ccc(Cl)c(Cl)c2)c2ccc(OCCCN3CCC(F)CC3)cc2C1 |w:3.3|
CN1CC(c2ccc(OCCCN3CCC(F)CC3)cc2C1)c1cc(Cl)ccc1Cl |w:3.24|
CCN(CC)CCc1ccc2cc(ccc2c1)-c1ccc(cc1)C#N
CN(CCc1ccc2cc(ccc2c1)-c1ccc(cc1)C#N)C(C)(C)C
FC[C@@H]1CCCN1CCc1ccc2cc(ccc2c1)-c1ccc(cc1)C#N
CN(C)[C@@H]1CCN(CCc2ccc3cc(ccc3c2)-c2ccc(cc2)C#N)C1
CCCN(C)CCc1ccc2cc(ccc2c1)-c1ccc(cc1)C#N
CCN(CCc1ccc2cc(ccc2c1)-c1ccc(cc1)C#N)C(C)C
N#Cc1ccc(cc1)-c1ccc2cc(CCC3CCNC3)ccc2c1 |w:16.16|
CNC(O)Cc1ccc2cc(ccc2c1)-c1ccc(cc1)C#N |w:2.2|
C(CN1CCCCC1)C#Cc1ccc(CN2CCCCC2)cc1
CC[C@@H]1CCCN1CCc1ccc2cc(ccc2c1)-c1ccc(cc1)C#N
C[C@@H]1CCCCN1CCc1ccc2cc(ccc2c1)-c1ccc(cc1)C#N
CN(C)CCc1ccc2cc(ccc2c1)-c1ccc(cc1)C#N
OC[C@@H]1CCCN1CCc1ccc2cc(ccc2c1)-c1ccc(cc1)C#N
C[C@H]1CCCN1CCc1ccc2cc(ccc2c1)-c1ccc(cc1)C#N
OC[C@H]1CCCN1CCc1ccc2cc(ccc2c1)-c1ccc(cc1)C#N
CC1CCCN1CCc1ccc2cc(ccc2c1)-c1ccc(cc1)C#N |w:1.0|
N#Cc1ccc(cc1)-c1ccc2cc(CCN3CCCC3)ccc2c1
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1ccc(cc1)C#N
CC(C)C1CCCN1CCc1ccc2cc(ccc2c1)-c1ccc(cc1)C#N |w:3.2|
CC(C)CC1CCCN1CCc1ccc2cc(ccc2c1)-c1ccc(cc1)C#N |w:4.3|
C[C@@H]1CCCN1CCc1ccc2cc(ccc2c1)-c1ccc(cc1)C#N
O[C@@H]1CCN(CCc2ccc3cc(ccc3c2)-c2ccc(cc2)C#N)C1
CCN(CC)CCCOc1cc2CN(C)CC(c3ccc(Cl)c(Cl)c3)c2cn1 |w:16.16|
CN1CC(c2ccc(F)cc2)c2cnc(OCCCN3CCCCC3)cc2C1 |w:3.3|
CN1CC(c2ccccc2)c2cnc(OCCCN3CCCCC3)cc2C1 |w:3.3|
CC(C)N1CCC(COc2cc3CN(C)CC(c4ccc(Cl)c(Cl)c4)c3cn2)CC1 |w:16.16|
COc1ccc(cc1)C1CN(C)Cc2cc(OCC3CCN(CC3)C(C)C)ncc12 |w:8.8|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCOCC3)ncc12 |w:8.8|
CN1CC(c2ccc(Cl)c(F)c2)c2cnc(OCCCN3CCCCC3)cc2C1 |w:3.3|
CCN(CC)CCCOc1cc2CNCC(c3ccc(Cl)c(Cl)c3)c2cn1 |w:15.15|
COc1cccc(c1)C1CN(C)Cc2cc(OCCCN3CCCCC3)ncc12 |w:8.8|
COc1ccc(cc1)C1CNCc2cc(OCCCN3CCCCC3)ncc12 |w:8.8|
CN1CC(c2ccc(Cl)cc2)c2cnc(OCCCN3CCCCC3)cc2C1 |w:3.3|
CN1CC(c2cccc(Cl)c2)c2cnc(OCCCN3CCCCC3)cc2C1 |w:3.3|
CCN(CC)CCCOc1cc2CNCC(c3ccc(OC)cc3)c2cn1 |w:15.15|
CN1CC(c2ccccc2F)c2cnc(OCCCN3CCCCC3)cc2C1 |w:3.3|
C(COc1cc2CNCC(c3ccccc3)c2cn1)CN1CCCCC1 |w:9.9|
CN1CC(c2ccc(Cl)c(Cl)c2)c2cnc(OCCCN3CCCCC3)cc2C1 |w:3.3|
Clc1ccccc1C1CNCc2cc(OCCCN3CCCCC3)ncc12 |w:7.7|
COc1ccc(cc1)C1CN(C)Cc2cc(OCCCN3CCCCC3)ncc12 |w:8.8|
Clc1ccc(cc1)C1CNCc2cc(OCCCN3CCCCC3)ncc12 |w:7.7|
CC(C)N1CCC(COc2cc3CNCC(c4ccc(Cl)c(Cl)c4)c3cn2)CC1 |w:15.15|
COc1ccc(cc1)C1CNCc2cc(OCCCN3CCOCC3)ncc12 |w:8.8|
COc1ccc(cc1)C1CNCc2cc(OCC3CCN(CC3)C(C)C)ncc12 |w:8.8|
CCN(CC)CCCOc1cc2CN(C)CC(c3ccccc3)c2cn1 |w:16.16|
C(COc1cc2CNCC(c3ccccc3)c2cn1)CN1CCOCC1 |w:9.9|
Clc1ccc(cc1Cl)C1CNCc2cc(OCCCN3CCCCC3)ncc12 |w:8.8|
CCN(CC)CCCOc1cc2CN(C)CC(c3ccc(OC)cc3)c2cn1 |w:16.16|
Oc1ccc(cc1)C1CN2CCCC2c2cc(OCCCN3CCCCC3)ccc12 |w:13.13,7.7|
COc1ccc(cc1)C1CN2CCCC2c2cc(OCCCN3CCCCC3)ccc12 |w:14.14,8.8|
FC(F)(F)c1cccc(c1)C1CN2CCCC2c2cc(OCCCN3CCCCC3)ccc12 |w:16.16,10.10|
COc1cccc(c1)C1CN2CCCC2c2cc(OCCCN3CCCCC3)ccc12 |w:14.14,8.8|
FC(F)(F)Oc1ccc(cc1)C1CN2CCCC2c2cc(OCCCN3CCCCC3)ccc12 |w:17.17,11.11|
Cc1ccc(cc1)C1CN2CCCC2c2cc(OCCCN3CCCCC3)ccc12 |w:7.7,13.13|
Clc1cccc(c1)C1CN2CCCC2c2cc(OCCCN3CCCCC3)ccc12 |w:7.7,13.13|
Oc1cccc(c1)C1CN2CCCC2c2cc(OCCCN3CCCCC3)ccc12 |w:13.13,7.7|
C(COc1ccc2C(CN3CCCC3c2c1)c1ccccc1)CN1CCCCC1 |w:7.18,13.12|
Clc1ccccc1C1CN2CCCC2c2cc(OCCCN3CCCCC3)ccc12 |w:7.7,13.13|
CSc1ccc(cc1)C1CN2CCCC2c2cc(OCCCN3CCCCC3)ccc12 |w:8.8,14.14|
[O-][N+](=O)c1ccc(cc1)C1CN2CCCC2c2cc(OCCCN3CCCCC3)ccc12 |w:15.15,9.9|
FC(F)(F)c1ccc(cc1)C1CN2CCCC2c2cc(OCCCN3CCCCC3)ccc12 |w:16.16,10.10|
COc1ccccc1C1CN2CCCC2c2cc(OCCCN3CCCCC3)ccc12 |w:14.14,8.8|
N#Cc1ccc(cc1)C1CN2CCCC2c2cc(OCCCN3CCCCC3)ccc12 |w:8.8,14.14|
Fc1ccc(cc1)C1CN2CCCC2c2cc(OCCCN3CCCCC3)ccc12 |w:7.7,13.13|
CN(C)c1ccc(cc1)C1CN2CCCC2c2cc(OCCCN3CCCCC3)ccc12 |w:15.15,9.9|
Clc1ccc(cc1)C1CN2CCCC2c2cc(OCCCN3CCCCC3)ccc12 |w:7.7,13.13|
Oc1ccccc1C1CN2CCCC2c2cc(OCCCN3CCCCC3)ccc12 |w:13.13,7.7|
C#Cc1ccc(cc1)C1CN2CCCC2c2cc(OCCCN3CCCCC3)ccc12 |w:8.8,14.14|
C#Cc1cccc(c1)C1CN2CCCC2c2cc(OCCCN3CCCCC3)ccc12 |w:8.8,14.14|
CN(C)CCC(Oc1ccc(Cl)c(Cl)c1)c1ccc(OCCCN2CCCCC2)cc1 |w:5.4|
CN(C)CCC(Oc1ccc(cc1)C(F)(F)F)c1ccc(OCCCN2CCCCC2)cc1 |w:5.4|
CSc1ccc(OC(CCN(C)C)c2ccc(OCCCN3CCCCC3)cc2)cc1 |w:7.7|
CN(C)CCC(Oc1cccc(Cl)c1)c1ccc(OCCCN2CCCCC2)cc1 |w:5.4|
CN(C)CCC(Oc1ccc(C)cc1)c1ccc(OCCCN2CCCCC2)cc1 |w:5.4|
CN(C)CCC(Oc1ccc(OCCCN2CCCCC2)cc1)c1ccccc1 |w:5.4|
CN(C)CCC(Oc1ccc(cc1)[N+]([O-])=O)c1ccc(OCCCN2CCCCC2)cc1 |w:5.4|
CN(C)CCC(Oc1ccc(cc1)C#N)c1ccc(OCCCN2CCCCC2)cc1 |w:5.4|
CC(C)N1CCN(CC1)C(=O)c1ccc(cc1)C(CCN(C)C)Oc1ccc(cc1)C(F)(F)F |w:17.19|
CN(C)CCC(Oc1ccc(Br)cc1)c1ccc(OCCCN2CCCCC2)cc1 |w:5.4|
CN(C)CCC(Oc1cccc(Br)c1)c1ccc(OCCCN2CCCCC2)cc1 |w:5.4|
CN(C)CCC(Oc1ccc(cc1)C(F)(F)F)c1ccc(cc1)C#CCCN1CCCCC1 |w:5.4|
CN(C)CCC(Oc1ccccc1)c1ccc(cc1)C#CCCN1CCCCC1 |w:5.4|
CC(C)N1CCC(CC1)Oc1ccc(cc1)C(CCN(C)C)Oc1ccccc1 |w:16.18|
CN(C)CCC(Oc1ccc(F)cc1)c1ccc(OCCCN2CCCCC2)cc1 |w:5.4|
COc1ccc(OC(CCN(C)C)c2ccc(OCCCN3CCCCC3)cc2)cc1 |w:7.7|
CN(C)CCC(Oc1cccc(OCCCN2CCCCC2)c1)c1ccccc1 |w:5.4|
COc1cccc(OC(CCN(C)C)c2ccc(OCCCN3CCCCC3)cc2)c1 |w:8.8|
CN(C)CCC(Oc1ccccc1)c1ccc(OCCCN2CCCCC2)cc1 |w:5.5|
CN(C)CCC(Oc1ccc(Cl)cc1)c1ccc(OCCCN2CCCCC2)cc1 |w:5.4|
CN(C)CCC(Oc1ccccc1)c1cccc(OCCCN2CCCCC2)c1 |w:5.4|
CC(C)N1CCN(CC1)C(=O)c1ccc(cc1)C(CCN(C)C)Oc1ccccc1 |w:17.19|
CN(C)CCC(Oc1ccc(cc1)C(F)(F)F)c1ccccc1
CN(C)Cc1cc(OCCCN2CCCCC2)ccc1OCc1ccccc1Cl
CN(C)Cc1cc(OCCCN2CCCCC2)ccc1Nc1ncnc2ccccc12
COc1ccccc1COc1ccc(OCCCN2CCOCC2)cc1C(=O)N(C)C
CN(C)CCCOc1ccc(OCc2ccccc2Cl)c(CN(C)C)c1
CN(C)CCCOc1ccc(Oc2ncnc3ccccc23)c(c1)C(=O)N(C)C
CN(C)C(=O)c1cc(OCCC2CCCN2C)ccc1OCc1ccccc1Cl |w:11.10|
CN(C)C(=O)c1cc(OCCCN2CCOCC2)ccc1OCc1ccccc1Cl
COc1ccccc1COc1ccc(OCCCN2CCCCC2)cc1C(=O)N(C)C
CC(C)N1CCC(C1)Oc1ccc(OCc2ccccc2Cl)c(CN(C)C)c1 |w:6.8|
CN(C)CCCOc1ccc(Nc2ncnc3ccccc23)c(CN(C)C)c1
CN(C)Cc1cc(OCC2CCCN(C)C2)ccc1OCc1ccccc1Cl |w:9.8|
CN(C)C(=O)c1cc(OCCCN2CCCCC2)ccc1OCc1ccccc1Cl
Oc1cc(cc2c1N=C(Nc1ccccc1Oc1ccccc1)NS2(=O)=O)[N+]([O-])=O |t:8|
FCc1nc(cs1)C#Cc1cc(F)cc(c1)C#N
C(COc1ccc2[C@@H](CN3CCC[C@@H]3c2c1)c1ccc(cc1)-n1ccnc1)CN1CCOCC1
C(COc1ccc2[C@@H](CN3CCC[C@@H]3c2c1)c1cnccn1)CN1CCOCC1
C(COc1ccc2[C@@H](CN3CCC[C@@H]3c2c1)c1ccn[nH]1)CN1CCOCC1
C(COc1ccc2[C@@H](CN3CCC[C@@H]3c2c1)c1cccs1)CN1CCOCC1
C(COc1ccc2[C@@H](CN3CCC[C@@H]3c2c1)c1cccnc1)CN1CCOCC1
C(COc1ccc2[C@@H](CN3CCC[C@@H]3c2c1)c1cccs1)CN1CCCCC1
C(COc1ccc2[C@@H](CN3CCC[C@@H]3c2c1)c1cncs1)CN1CCOCC1
C(COc1ccc2[C@@H](CN3CCC[C@@H]3c2c1)c1ccccn1)CN1CCCCC1
C(COc1ccc2[C@@H](CN3CCC[C@@H]3c2c1)c1ccsc1)CN1CCOCC1
C(COc1ccc2[C@@H](CN3CCC[C@@H]3c2c1)c1cccnc1)CN1CCCCC1
C(COc1ccc2[C@@H](CN3CCC[C@@H]3c2c1)c1ccc(cc1)-n1cccn1)CN1CCOCC1
C(COc1ccc2[C@@H](CN3CCC[C@@H]3c2c1)c1ccncc1)CN1CCCCC1
C(COc1ccc2[C@@H](CN3CCC[C@@H]3c2c1)c1ccccn1)CN1CCOCC1
C(COc1ccc2[C@@H](CN3CCC[C@@H]3c2c1)c1ccsc1)CN1CCCCC1
C(COc1ccc2[C@@H](CN3CCC[C@@H]3c2c1)c1cnc2ccccn12)CN1CCOCC1
C(COc1ccc2[C@@H](CN3CCC[C@@H]3c2c1)c1nccs1)CN1CCOCC1
CNCc1cc(ccc1Oc1ccc(F)cc1Cl)C#CCCN1CCOCC1
CNCc1cc(ccc1Oc1ccc(SC)cc1)C#CCCN1CCN(C(C)C)C(=O)C1
C(CN1CCCCC1)C#Cc1cccc(CN2CCOCC2)c1
CNCc1cc(ccc1Oc1ccc(cc1)C(F)(F)F)C#CCCN1CCOCC1
CNCc1cc(ccc1Oc1cccc(Cl)c1)C#CCCN1CCOCC1
CNCc1cc(ccc1Oc1ccc(SC)cc1)C#CCCN1CCNC(=O)C1
CNCc1cc(ccc1Oc1ccc(SC)cc1)C#CCCN1CCOCC1
CNCc1cc(ccc1Oc1ccc(Cl)c(Cl)c1)C#CCCN1CCSCC1
CNCc1cc(ccc1Oc1ccc(Cl)c(Cl)c1)C#CCCN(C)C1CC1
CNCc1cc(ccc1Oc1ccc(SC)cc1)C#CCCN1CCC(F)CC1
CC(C)N1CCC(CC1)Oc1ccc(CN2CCOCC2)cc1
CNCc1cc(ccc1Oc1ccccc1)C#CCCN1CCOCC1
CNCc1cc(CCCCN2CCSCC2)ccc1Oc1ccc(SC)cc1
CNCc1cc(ccc1Oc1ccc(Cl)cc1)C#CCCN1CCOCC1
CNCc1cc(ccc1Oc1ccc(Cl)c(c1)C(F)(F)F)C#CCCN1CCOCC1
CNCc1cc(ccc1Oc1ccc(Cl)c(Cl)c1)C#CCCNC1CC1
CNCc1cc(ccc1Oc1ccc(Cl)c(Cl)c1)C#CCCN1CCC(F)CC1
COc1ccc(cc1)[C@@H]1CN2CCC[C@@H]2c2cc(OCCCN3CCCCC3)ccc12
CNCc1cc(ccc1Oc1ccc(SC)c(C)c1)C#CCCN1CCOCC1
CNCc1cc(ccc1Oc1ccc(SC)cc1)C#CCCN(C)C1CC1
CNCc1cc(ccc1Oc1ccc(SC)cc1)C#CCCN1CCN(CC1)C1CC1
CNCc1cc(ccc1Oc1ccc(Cl)c(Cl)c1)C#CCCN1CCOCC1
COc1ccc(cc1)[C@@H]1CN(C)Cc2cc(OCCCN3CCC(F)CC3)ccc12
CNCc1cc(ccc1Oc1ccc(SC)cc1)C#CCCN1CCN(CC1)C(C)C
CNCc1cc(Br)ccc1Oc1ccc(SC)cc1
CNCc1cc(ccc1Oc1ccc(SC)cc1)C#CCCN1CCSCC1
CNCc1cc(CCCCN2CCN(CC2)C(C)C)ccc1Oc1ccc(SC)cc1
CNCc1cc(ccc1Oc1ccc(SC)cc1)C#CCCN1CCCN(CC1)C(C)C
CNCc1ccc(cc1Oc1ccc(SC)cc1)C#CCCN1CCOCC1
CNCc1cc(ccc1Oc1cccc(F)c1)C#CCCN1CCOCC1
CNCc1cc(ccc1Oc1ccc(SC)cc1)C#CCCN1CCCCC1
CNCc1cc(CCCCN2CCN(CC2)C2CC2)ccc1Oc1ccc(SC)cc1
CNCc1cc(ccc1Oc1ccc(SC)cc1)C#CCCNC1CC1
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cnn(c1C)-c1ccccn1
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cc2cccnc2nc1C
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cnc(nc1C)N1CCCC1
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cn(C)nc1C
CCOc1ccc(nn1)-n1ncc(c1C)-c1ccc2cc(CCN3CCC[C@H]3C)ccc2n1
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cnc2cc(C)nn2c1C
[#6]-[#6]-1-[#6]-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#7]1-[#6]-[#6]-[#7](-[#6]-[#6]-[#7]-2-[#6]-[#6]-[#6]-[#6]-2-[#6])\[#6]-1=[#6](/C#N)C#N |w:1.0,18.20|
[#6]-[#6@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#7]1-[#6]-[#6]-[#7](-[#6]-[#6]-[#7]-2-[#6]-[#6]-[#6]-[#6@@H]-2-[#6])\[#6]-1=[#6](/C#N)C#N
N#C\[#6](C#N)=[#6]-1/[#7](-[#6]-[#6]-[#6]-[#7]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#6]-[#6]-[#6]-1
[#6]-[#6@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#7]1-[#6]-[#6]-[#7](-[#6]-[#6]-[#7]-2-[#6]-[#6]-[#6]-[#6@H]-2-[#6])\[#6]-1=[#6](\C#N)C#N
N#C\[#6](C#N)=[#6]-1/[#7](-[#6]-[#6]-[#6]-[#6]-[#7]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#6]-[#6]-[#6]-1
[#6]-[#6]-1-[#6]-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#7]1-[#6]-[#6]-[#7](-[#6]-[#6]-[#7]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)\[#6]-1=[#6](/C#N)C#N |w:1.0|
[#6]-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#7]1-[#6]-[#6]-[#7](-[#6]-[#6]-[#7]-2-[#6]-[#6]-[#6]-[#6@H]-2-[#6])\[#6]-1=[#6](/C#N)C#N
[#6]-[#6]-[#7](-[#6]-[#6]-[#6]-[#7](-[#6])-[#6])-[#6]-[#6]-[#7]1-[#6]-[#6]-[#7](-[#6]-c2cccc3ccccc23)\[#6]-1=[#6](/C#N)C#N
N#C\[#6](C#N)=[#6]-1\[#7](-[#6]-[#6]-[#6]-[#7]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)-[#6]-[#6]-[#7]-1-[#6]-c1cccc2ccccc12
N#C\[#6](C#N)=[#6]-1\[#7](-[#6]-[#6]-[#6]-[#7]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#6]-[#6]-[#6]-1
N#C\[#6](C#N)=[#6]-1\[#7](-[#6]-[#6]-[#7]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#6]-[#6]-[#6]-1
NCCc1c[nH]cn1
C(Cc1ccc(cc1)C1=CC[C@H]2CN(CC3CC3)C[C@@H]12)N1CCCC1 |r,t:9|
C[C@@H]1CCCN1CCc1ccc(cc1)C1=CC[C@H]2CN(C[C@@H]12)C(=O)C1CCOCC1 |r,t:16|
C[C@@H]1CCCN1CCc1ccc(cc1)C1=CC[C@H]2CN(C[C@@H]12)C(=O)Cc1ccccc1 |r,t:16|
C[C@@H]1CCCN1CCc1ccc(cc1)C1=CC[C@H]2CN(C[C@@H]12)C(=O)c1cccnc1 |r,t:16|
C[C@@H]1CCCN1CCc1ccc(cc1)C1=CC[C@H]2CN(C[C@@H]12)C(=O)c1ccccc1 |r,t:16|
C[C@@H]1CCCN1CCc1ccc(cc1)C1=CC[C@H]2CN(C[C@@H]12)C(=O)C1CCCC1 |r,t:16|
CC(C)C(=O)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCC[C@H]2C)cc1 |r,c:9|
OCC(=O)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1 |r,c:8|
O=C(C1CCOC1)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1 |r,c:12|
O=C(C1CCCC1)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1 |r,c:12|
CC(C)C(=O)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1 |r,c:9|
O=C(Cc1ccccc1)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1 |r,c:14|
O=C(N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1)c1cccnc1 |r,c:6|
O=C(N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1)c1ccccc1 |r,c:6|
O=S(=O)(N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1)c1ccccc1 |r,c:7|
O=S(=O)(Cc1ccccc1)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1 |r,c:15|
CC(C)S(=O)(=O)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1 |r,c:10|
CS(=O)(=O)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1 |r,c:8|
O=C(N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1)N1CCOCC1 |r,c:6|
CN(C)C(=O)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1 |r,c:9|
O=C(NC1CCCC1)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1 |r,c:13|
CC(C)NC(=O)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1 |r,c:10|
CCN(CC)CCCOc1ccc(cc1)-n1c(C)nc2ccccc2c1=O
CC1CC(C)CN(CCCOc2ccc(cc2)-n2c(C)nc3ccccc3c2=O)C1
CC1CCN(CCCOc2ccc(cc2)-n2c(C)nc3ccccc3c2=O)CC1
C[C@@H]1CCCN(CCCOc2ccc(cc2)-n2c(C)nc3ccccc3c2=O)C1 |r|
C[C@H]1CCCN(CCCOc2ccc(cc2)-n2c(C)nc3ccccc3c2=O)C1 |r|
CC1CCCCN1CCCOc1ccc(cc1)-n1c(C)nc2ccccc2c1=O
C[C@@H]1CC[C@@H](C)N1CCCOc1ccc(cc1)-n1c(C)nc2ccccc2c1=O |r|
CC1CCN(CCCOc2ccc(cc2)-n2c(C)nc3ccccc3c2=O)C1
C[C@@H]1CCCN1CCCOc1ccc(cc1)-n1c(C)nc2ccccc2c1=O |r|
C[C@H]1CCCN1CCCOc1ccc(cc1)-n1c(C)nc2ccccc2c1=O |r|
Cc1nc2ccccc2c(=O)n1-c1ccc(OCCCN2CCCCCCC2)cc1
Cc1nc2ccccc2c(=O)n1-c1ccc(OCCCN2CCCCCC2)cc1
Cc1nc2ccccc2c(=O)n1-c1ccc(OCCCN2CCCCC2)cc1
Cc1nc2ccccc2c(=O)n1-c1ccc(OCCCN2CCCC2)cc1
O=c1n(cnc2ccccc12)-c1ccc(OCCCN2CCCC2)cc1
Cc1nc2c(cccc2c(=O)n1-c1ccc(OCCCN2CCCC2)cc1)C(F)(F)F
Cc1nc2cc(ccc2c(=O)n1-c1ccc(OCCCN2CCCC2)cc1)C(F)(F)F
Cc1nc2cccc(Cl)c2c(=O)n1-c1ccc(OCCCN2CCCC2)cc1
Cc1nc2c(F)cccc2c(=O)n1-c1ccc(OCCCN2CCCC2)cc1
Cc1nc2cc(F)ccc2c(=O)n1-c1ccc(OCCCN2CCCC2)cc1
Cc1nc2ccc(F)cc2c(=O)n1-c1ccc(OCCCN2CCCC2)cc1
Cc1nc2cccc(F)c2c(=O)n1-c1ccc(OCCCN2CCCC2)cc1
COc1cccc2c1nc(C)n(-c1ccc(OCCCN3CCCC3)cc1)c2=O
COc1ccc2c(c1)nc(C)n(-c1ccc(OCCCN3CCCC3)cc1)c2=O
COc1ccc2nc(C)n(-c3ccc(OCCCN4CCCC4)cc3)c(=O)c2c1
COc1cccc2nc(C)n(-c3ccc(OCCCN4CCCC4)cc3)c(=O)c12
Cc1cccc2c1nc(C)n(-c1ccc(OCCCN3CCCC3)cc1)c2=O
Cc1ccc2c(c1)nc(C)n(-c1ccc(OCCCN3CCCC3)cc1)c2=O
Cc1ccc2nc(C)n(-c3ccc(OCCCN4CCCC4)cc3)c(=O)c2c1
Cc1cccc2nc(C)n(-c3ccc(OCCCN4CCCC4)cc3)c(=O)c12
O=c1n(-c2ccc(OCCCN3CCCC3)cc2)c(nc2ccccc12)-c1ccccc1
CC(C)c1nc2ccccc2c(=O)n1-c1ccc(OCCCN2CCCC2)cc1
CCCc1nc2ccccc2c(=O)n1-c1ccc(OCCCN2CCCC2)cc1
CCc1nc2ccccc2c(=O)n1-c1ccc(OCCCN2CCCC2)cc1
Fc1ccc2n(c(nc2c1)-c1ccccn1)-c1ccc(OCCCN2CCCCC2)cc1
CC1CC(C)CN(CCCOc2ccc(cc2)-n2c(nc3cc(F)ccc23)-c2ccccn2)C1
Fc1ccc2n(c(nc2c1)-c1ccccn1)-c1ccc(OCCCN2CCOCC2)cc1
Fc1ccc2n(c(nc2c1)-c1ccccn1)-c1ccc(OCCCN2CCC(Cc3ccccc3)CC2)cc1
CN1CCN(CCCOc2ccc(cc2)-n2c(nc3cc(F)ccc23)-c2ccccn2)CC1
Fc1ccc2n(c(nc2c1)-c1ccccn1)-c1ccc(OCCCN2CCCC2)cc1
C[C@@H]1CC[C@@H](C)N1CCCOc1ccc(cc1)-n1c(nc2cc(F)ccc12)-c1ccccn1 |r|
CC(C)[C@@H]1CCN(CCCOc2ccc(cc2)-n2c(nc3cc(F)ccc23)-c2ccccn2)C1 |r|
Fc1ccc2n(c(nc2c1)-c1ccccn1)-c1ccc(OCCCN2CCSC2)cc1
Fc1ccc2n(c(nc2c1)-c1ccccn1)-c1ccc(OCCCN2CCCCCC2)cc1
CN1CCCN(CCCOc2ccc(cc2)-n2c(nc3cc(F)ccc23)-c2ccccn2)CC1
Fc1ccc2n(c(nc2c1)-c1ccccn1)-c1ccc(OCCCN2CCc3ccccc3C2)cc1
Fc1ccc2n(c(nc2c1)-c1ccccn1)-c1ccc(OCCCN2Cc3cccc4cccc(C2)c34)cc1
OC1CCN(CCCOc2ccc(cc2)-n2c(nc3cc(F)ccc23)-c2ccccn2)CC1
COC(=O)C1CCN(CCCOc2ccc(cc2)-n2c(nc3cc(F)ccc23)-c2ccccn2)CC1
NC(=O)C1CCN(CCCOc2ccc(cc2)-n2c(nc3cc(F)ccc23)-c2ccccn2)CC1
NC(=O)C1CCCN(CCCOc2ccc(cc2)-n2c(nc3cc(F)ccc23)-c2ccccn2)C1
CNCCCOc1ccc(cc1)-n1c(nc2cc(F)ccc12)-c1ccccn1
Fc1ccc2n(-c3ccc(OCCCN4CCCCC4)cc3)c(=O)[nH]c2c1
Fc1ccc2n(-c3ccc(OCCCN4CCCCC4)cc3)c(=S)[nH]c2c1
CCSC1Nc2cc(F)ccc2N1c1ccc(OCCCN2CCCCC2)cc1
CCOC1Nc2cc(F)ccc2N1c1ccc(OCCCN2CCCCC2)cc1
Clc1ccc(cc1)C1=NN(C[C@@H]1c1ccccc1)C(=N)NS(=O)(=O)c1ccc(cc1)C#N |r,t:8|
CN(CCN1CCCCC1)C(=O)N1CCC(CC1)c1cccc2ccccc12
CN(CCN1CCCCC1)C(=O)N1CCC(CC1)c1ccccc1
CN(CCN1CCCCC1)C(=O)N1CCc2ccccc2C1
CN(CCN1CCCCC1)C(=O)N1CCN(CC1)c1ccccc1Cl
CN(CCN1CCCCC1)C(=O)N1CCC(CC1)(C#N)c1ccccc1
CN(CCN1CCCCC1)C(=O)N1CCC(O)(CC1)c1ccccc1
CN(CCN1CCCCC1)C(=O)N1CCN(CC1)c1ccccc1
CN(CCN1CCCCC1)C(=O)N1CCC(Cc2ccccc2)CC1
CN(CCN1CCCCC1)C(=O)N1CCC(CC1)C(=O)c1ccccc1
CN(CCN1CCCCC1)C(=O)N1CCC2(Cc3ccccc3C2)CC1
CN(CCN1CCCCC1)C(=O)N1CCC(CC1)(c1ccccc1)c1ccccc1
CN(CCN1CCCCC1)C(=O)N1CCC(CC1)c1ccc2ccccc2c1
CN(CCN1CCCCC1)C(=O)N1CCN(CC1)c1cccc(Cl)c1
CN(CCN1CCCCC1)C(=O)N1CCN(CC1)c1ccc(Cl)cc1
CN(CCN1CCCCC1)C(=O)N1CCC(CC1)C(C)(C)C
CN(CCN1CCCCC1)C(=O)N1CCC2(CC1)NC(=O)Cc1ccccc21
CN(CCN1CCCCC1)C(=O)N1CCC2(CC1)OC(=O)Nc1ccccc21
CN(CCN1CCCCC1)C(=O)N1CCC2(CC1)NC(=O)c1ccccc1N2
CN(CCN1CCCCC1)C(=O)N1CCC2(CC1)Cc1ccccc1C(=O)O2
CN(CCN1CCCCC1)C(=O)N1CCC2(CC1)CC(=O)c1ccccc1O2
CN(CCN1CCCCC1)C(=O)N1CCC2(CC(=O)c3ccccc23)CC1
CN(CCN1CCCCC1)C(=O)N1CCC2(CC1)NC(=O)c1ccccc21
CN(CCN1CCCCC1)C(=O)N1CCC2(CC1)N(C)C(=O)c1ccccc21
CN(CCN1CCCCC1)C(=O)N1CCC2(CC1)OC(=O)c1ccccc21
CN(CCN1CCCCC1)C(=O)N1CCC2(CC1)OCc1ccccc21
CN(CCN1CCCCC1)C(=O)[C@H]1CC[C@@]2(CC1)OC(=O)c1ccccc21 |r,wU:15.19,wD:12.12,(3.45,4.02,;2.11,3.26,;2.11,1.72,;3.44,.94,;3.44,-.6,;2.1,-1.35,;2.09,-2.88,;3.42,-3.67,;4.76,-2.9,;4.77,-1.36,;.78,4.03,;.79,5.57,;-.55,3.27,;-1.88,4.04,;-3.21,3.27,;-3.21,1.73,;-1.88,.96,;-.55,1.73,;-3.14,.18,;-4.58,-.37,;-4.98,-1.85,;-5.55,.84,;-7.09,.92,;-7.79,2.29,;-6.94,3.6,;-5.4,3.51,;-4.7,2.13,)|
COc1ccc2c(c1)C(=O)O[C@]21CC[C@@H](CC1)C(=O)N(C)CCN1CCCCC1 |r,wU:11.11,wD:14.19,(9.71,4.04,;10.41,2.67,;11.95,2.59,;12.79,3.89,;14.34,3.8,;15.03,2.43,;14.18,1.13,;12.64,1.22,;15.15,-.07,;14.75,-1.56,;16.6,.48,;16.52,2.02,;16.52,3.56,;17.85,4.34,;19.18,3.56,;19.18,2.02,;17.85,1.26,;20.51,4.33,;20.52,5.87,;21.85,3.55,;23.18,4.32,;21.84,2.01,;23.17,1.24,;23.17,-.3,;21.83,-1.06,;21.82,-2.59,;23.15,-3.37,;24.49,-2.61,;24.5,-1.06,)|
COc1ccc2C(=O)O[C@]3(CC[C@@H](CC3)C(=O)N(C)CCN3CCCCC3)c2c1 |r,wU:9.8,wD:12.15,(-5.23,-6.51,;-6.07,-7.8,;-5.38,-9.18,;-6.22,-10.48,;-5.52,-11.85,;-3.99,-11.93,;-3.02,-13.14,;-3.42,-14.62,;-1.57,-12.59,;-1.65,-11.04,;-1.65,-9.5,;-.32,-8.73,;1.01,-9.5,;1.01,-11.04,;-.32,-11.81,;2.35,-8.74,;2.35,-7.2,;3.68,-9.51,;5.01,-8.75,;3.67,-11.05,;5,-11.83,;5,-13.37,;3.66,-14.12,;3.65,-15.66,;4.98,-16.44,;6.32,-15.67,;6.33,-14.13,;-3.14,-10.64,;-3.83,-9.26,)|
COc1cccc2C(=O)O[C@]3(CC[C@@H](CC3)C(=O)N(C)CCN3CCCCC3)c12 |r,wU:10.9,wD:13.16,(14.73,-6.83,;15.42,-8.21,;14.58,-9.5,;13.03,-9.41,;12.19,-10.71,;12.89,-12.08,;14.42,-12.17,;15.39,-13.37,;14.99,-14.86,;16.84,-12.82,;16.76,-11.28,;16.76,-9.74,;18.09,-8.96,;19.42,-9.74,;19.42,-11.28,;18.09,-12.04,;20.76,-8.97,;20.76,-7.43,;22.09,-9.75,;23.42,-8.98,;22.08,-11.29,;23.41,-12.06,;23.41,-13.6,;22.07,-14.36,;22.06,-15.89,;23.39,-16.67,;24.73,-15.91,;24.74,-14.36,;15.27,-10.87,)|
CCCC1CCN(CCCOCCCc2ccccc2)CC1
CCCCC1CCN(CCCOCCCc2ccccc2)CC1
C(COCCCc1ccccc1)CN1CCC(Cc2ccccc2)CC1
C(COCCCc1ccccc1)CN1CCC2CCCCC2C1
C(COCCCc1ccccc1)CN1CCc2ccccc2C1
Clc1cccc(OCCN2CCC(CC2)N2CCCCC2)c1
COc1cccc(OCCN2CCC(CC2)N2CCCCC2)c1
COc1cccc(OCCCN2CCC(CC2)N2CCCCC2)c1
FC(F)(F)c1cccc(OCCN2CCC(CC2)N2CCCCC2)c1
Cc1ccc(OCCN2CCC(CC2)N2CCCCC2)cc1
Clc1ccc(OCCN2CCC(CC2)N2CCCCC2)cc1
Clc1ccc(OCCCN2CCC(CC2)N2CCCCC2)cc1
CC(C)(C)c1ccc(OCCCN2CCC(CC2)N2CCCCC2)cc1
C(COCCCc1ccccc1)CN1CCCCC1
CNC(=O)C(CCN1CCC(O)(CC1)c1ccc(Cl)cc1)(c1ccccc1)c1ccccc1
CN(C)CCCOc1ccc(CCNC(=O)c2cc(Br)c[nH]2)cc1Br
CNC(=O)c1ccc(Oc2ccc3CCN(CCc3c2)C2CCC2)nc1
Cc1nc2ccccc2c(=O)n1-c1ccc(OC2CCNCC2)cc1
CN1CCC(CC1)Oc1ccc(cc1)-n1c(C)nc2ccccc2c1=O
CCN1CCC(CC1)Oc1ccc(cc1)-n1c(C)nc2ccccc2c1=O
CCCN1CCC(CC1)Oc1ccc(cc1)-n1c(C)nc2ccccc2c1=O
CCCCN1CCC(CC1)Oc1ccc(cc1)-n1c(C)nc2ccccc2c1=O
CC(C)N1CCC(CC1)Oc1ccc(cc1)-n1c(C)nc2ccccc2c1=O
Cc1nc2ccccc2c(=O)n1-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cc1nc2ccccc2c(=O)n1-c1ccc(OC2CCN(CC2)C2CCCC2)cc1
Cc1nc2ccccc2c(=O)n1-c1ccc(OC2CCN(CC2)C2CCCCC2)cc1
Cc1nc2ccccc2c(=O)n1-c1ccc(OC2CCN(C2)C2CCC2)cc1
Cc1nc2ccccc2c(=O)n1-c1ccc(OC2CCN(C2)C2CCCC2)cc1
Cc1nc2ccccc2c(=O)n1-c1ccc(OC2CCCN(CC2)C2CCC2)cc1
Cc1nc2ccccc2c(=O)n1-c1ccc(OC2CCCN(CC2)C2CCCC2)cc1
Cc1nc2ccccc2c(=O)n1-c1ccc(OC2CCC(C2)N2CCCC2)cc1
Cc1nc2ccccc2c(=O)n1-c1ccc(O[C@H]2CC[C@H](CC2)N2CCCC2)cc1 |r,wU:17.18,20.25,(13.81,-35.86,;12.48,-36.64,;11.14,-35.87,;9.81,-36.65,;8.47,-35.89,;7.15,-36.66,;7.14,-38.2,;8.48,-38.97,;9.82,-38.2,;11.15,-38.96,;11.15,-40.5,;12.49,-38.19,;13.82,-38.95,;13.82,-40.49,;15.15,-41.26,;16.49,-40.49,;17.82,-41.25,;19.15,-40.47,;19.14,-38.94,;20.47,-38.17,;21.81,-38.94,;21.81,-40.48,;20.48,-41.25,;23.14,-38.16,;24.55,-38.79,;25.58,-37.64,;24.81,-36.31,;23.3,-36.63,;16.48,-38.94,;15.14,-38.18,)|
Cc1nc2ccccc2c(=O)n1-c1ccc(O[C@H]2CC[C@@H](CC2)N2CCCC2)cc1 |r,wU:17.18,wD:20.25,(33.03,-37.04,;31.7,-37.81,;30.36,-37.04,;29.03,-37.82,;27.69,-37.06,;26.36,-37.83,;26.36,-39.38,;27.7,-40.15,;29.03,-39.37,;30.37,-40.13,;30.37,-41.67,;31.71,-39.36,;33.04,-40.13,;33.04,-41.67,;34.37,-42.43,;35.71,-41.66,;37.04,-42.42,;38.37,-41.65,;38.35,-40.11,;39.69,-39.34,;41.03,-40.11,;41.03,-41.65,;39.7,-42.42,;42.36,-39.34,;43.76,-39.96,;44.79,-38.82,;44.02,-37.49,;42.52,-37.81,;35.7,-40.11,;34.36,-39.35,)|
Cc1nc2cccc(F)c2c(=O)n1-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cc1nc2ccc(F)cc2c(=O)n1-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cc1nc2cc(F)ccc2c(=O)n1-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cc1nc2c(F)cccc2c(=O)n1-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cc1nc2cc(F)c(F)cc2c(=O)n1-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cc1nc2cccc(Cl)c2c(=O)n1-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cc1nc2ccc(Cl)cc2c(=O)n1-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cc1nc2cc(Cl)ccc2c(=O)n1-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cc1nc2c(Cl)cccc2c(=O)n1-c1ccc(OC2CCN(CC2)C2CCC2)cc1
COc1cccc2nc(C)n(-c3ccc(OC4CCN(CC4)C4CCC4)cc3)c(=O)c12
COc1ccc2nc(C)n(-c3ccc(OC4CCN(CC4)C4CCC4)cc3)c(=O)c2c1
COc1ccc2c(c1)nc(C)n(-c1ccc(OC3CCN(CC3)C3CCC3)cc1)c2=O
COc1cccc2c1nc(C)n(-c1ccc(OC3CCN(CC3)C3CCC3)cc1)c2=O
Cc1nc2cccnc2c(=O)n1-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cc1nc2ccncc2c(=O)n1-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cc1nc2cnccc2c(=O)n1-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cc1nc2ncccc2c(=O)n1-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cc1cccc2nc(C)n(-c3ccc(OC4CCN(CC4)C4CCC4)cc3)c(=O)c12
Cc1nc2cccc(c2c(=O)n1-c1ccc(OC2CCN(CC2)C2CCC2)cc1)C(F)(F)F
COc1nccc2c1nc(-c1ccc(OC3CCN(CC3)C3CCC3)cc1)n(C)c2=O
Cn1c(nc2c(F)cccc2c1=O)-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cn1c(nc2c(cccc2c1=O)C(F)(F)F)-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cn1c(nc2c(Cl)cccc2c1=O)-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cc1cccc2c1nc(-c1ccc(OC3CCN(CC3)C3CCC3)cc1)n(C)c2=O
COc1cccc2c1nc(-c1ccc(OC3CCN(CC3)C3CCC3)cc1)n(C)c2=O
COc1ccc2c(c1)nc(-c1ccc(OC3CCN(CC3)C3CCC3)cc1)n(C)c2=O
COc1ccc2nc(-c3ccc(OC4CCN(CC4)C4CCC4)cc3)n(C)c(=O)c2c1
COc1cccc2nc(-c3ccc(OC4CCN(CC4)C4CCC4)cc3)n(C)c(=O)c12
Cn1c(nc2ccccc2c1=O)-c1ccc(OC2CCN(CC2)C2CCCC2)cc1
Cn1c(nc2ccccc2c1=O)-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cn1c(nc2ccccc2c1=O)-c1ccc(OCCCN2CCCC2)cc1
O=c1n(-c2ccccc2)c(nc2ccccc12)-c1ccc(OCCCN2CCCCC2)cc1
O=c1n(Cc2ccccc2)c(nc2ccccc12)-c1ccc(OCCCN2CCCCC2)cc1
CC(C)n1c(nc2ccccc2c1=O)-c1ccc(OCCCN2CCCCC2)cc1
CCCn1c(nc2ccccc2c1=O)-c1ccc(OCCCN2CCCCC2)cc1
CCn1c(nc2ccccc2c1=O)-c1ccc(OCCCN2CCCCC2)cc1
Cn1c(nc2ccccc2c1=O)-c1ccc(OCCCN2CCCCC2)cc1
CC1CCCN(CCCCCOc2ccc(Cl)cc2)C1
Clc1ccc(OCCCCCN2CCCCC2)cc1
Clc1ccc(OCCCCCCCN2CCCCC2)cc1
Clc1ccc(OCCCCCCCN2CCCCCC2)cc1
CC1CCN(CCCCCCCOc2ccc(Cl)cc2)CC1
CC1CCCN(CCCCCCCOc2ccc(Cl)cc2)C1
Clc1cccc(OCCCCCCCN2CCCCCC2)c1
CC1CCN(CCCCCCCOc2cccc(Cl)c2)CC1
CC1CCCN(CCCCCCCOc2cccc(Cl)c2)C1
Clc1cccc(OCCCCCCCN2CCCCC2)c1
Clc1ccc(OCCCCCCN2CCCCCC2)cc1
CC1CCN(CCCCCCOc2ccc(Cl)cc2)CC1
CC1CCCN(CCCCCCOc2ccc(Cl)cc2)C1
Clc1ccc(OCCCCCCN2CCCCC2)cc1
Clc1cccc(OCCCCCCN2CCCCCC2)c1
CC1CCN(CCCCCCOc2cccc(Cl)c2)CC1
CC1CCCN(CCCCCCOc2cccc(Cl)c2)C1
Clc1cccc(OCCCCCCN2CCCCC2)c1
Clc1ccc(OCCCCCN2CCCCCC2)cc1
CC1CCN(CCCCCOc2ccc(Cl)cc2)CC1
CN(C)CCCSc1ncc(Cc2ccc(Cl)cc2)n1C
CC(C)CCCSc1ncc(C(=O)c2ccc(Cl)cc2)n1C
Cn1c(SCCCN2CCCCC2)ncc1C(=O)c1ccc(Cl)cc1
CC(C)N1CCC(CC1)Sc1ncc(C(=O)c2ccc(Cl)cc2)n1C
CN(C)CCSc1ncc(Cc2ccc(Cl)cc2)n1C
Cn1c(SCCCCN2CCCCC2)ncc1C(=O)c1ccc(Cl)cc1
Cn1c(OCCCN2CCCCC2)ncc1C(=O)c1ccc(Cl)cc1
Cn1c(NCCCN2CCCCC2)ncc1C(=O)c1ccc(Cl)cc1
Cn1c(CCCCN2CCCCC2)ncc1C(=O)c1ccc(Cl)cc1
CC(C)N1CCC(CC1)Oc1ncc(C(=O)c2ccc(Cl)cc2)n1C
CC(C)N1CCC(COc2ncc(C(=O)c3ccc(Cl)cc3)n2C)CC1
CC(C)N1CCC(CCOc2ncc(C(=O)c3ccc(Cl)cc3)n2C)CC1
CC(C)N1CCC(COc2ncc(C(=O)c3ccccc3)n2C)CC1
CC(C)N1CCC(COc2ncc(C(=O)c3ccccc3Cl)n2C)CC1
CC(C)N1CCC(COc2ncc(C(=O)c3cccc(Cl)c3)n2C)CC1
CC(C)N1CCC(COc2ncc(C(=O)c3cc(Cl)cc(Cl)c3)n2C)CC1
CC(C)N1CCC(COc2ncc(C(=O)c3ccc(Br)cc3)n2C)CC1
CC(C)N1CCC(COc2ncc(C(=O)c3ccc(cc3)C(F)(F)F)n2C)CC1
CC(C)N1CCC(COc2ncc(C(=O)c3ccc(cc3)[N+]([O-])=O)n2C)CC1
CC(C)N1CCC(COc2ncc(C(=O)c3ccc(F)cc3)n2C)CC1
CC(C)N1CCC(COc2ncc(C(=O)c3ccc(cc3)C(C)C)n2C)CC1
NC(=N)N(CCCCCCCN1CCCC1)Cc1ccc(Cl)cc1
C1C[C@@H](N2CCCC[C@H]12)c1ccc(Sc2ccncc2)cc1 |r|
CN(C)CCCSc1ncc(C(=O)c2ccc(Cl)cc2)n1C
CN(C)CCCSc1ncc(C(N=O)c2ccc(Cl)cc2)n1C
CN(C)CCCSc1ncc(C(O)c2ccc(Cl)cc2)n1C
CN1CCN(CC1)c1nc(N)nc-2c1CCc1ccccc-21
CN1CCN(CC1)c1nc(NCc2ccccc2)nc-2c1CCc1ccccc-21
CN1CCN(CC1)c1cc(nc(NCc2ccccc2)n1)-c1ccccc1
CC(C)N1CCC(C1)NC(=O)c1ccc(OC2CCOCC2)cc1
CC(C)N1CCC(CC1)Oc1ccc(cc1)C(=O)NC1CCN(C1)C1CCC1
CC(C)N1CCC(CC1)NC(=O)c1ccc(OC2CCN(CC2)C(C)C)cc1
CC(C)N1CCC(CC1)NC(=O)c1ccc(OC2CCN(CC2)C2CCC2)cc1
CC(C)N1CCC(CC1)Oc1ccc(cc1F)C(=O)NC1CCN(C1)C1CCC1
CC(C)N1CCC(CC1)Oc1ccc(C(=O)NC2CCN(CC2)C2CCC2)c(F)c1
CC(C)N1CCC(CC1)NC(=O)c1ccc(OC2CCN(CC2)C(C)C)cc1F
CC(C)N1CCC(CC1)Oc1ccc(C(=O)NC2CCN(C2)C2CCC2)c(Cl)c1
CC(C)N1CCC(CC1)NC(=O)c1ccc(OC2CCN(CC2)C2CCC2)cc1Cl
Clc1cc(OC2CCN(CC2)C2CCC2)ccc1C(=O)NC1CCN(CC1)C1CCC1
CC(C)N1CCC(CC1)Oc1ccc(C(=O)NC2CCN(C2)C2CCC2)c(F)c1
CC(C)N1CCC(CC1)Oc1ccc(C(=O)NC2CCN(C2)C2CCC2)c(C)c1
CC(C)N1CCC(C1)NC(=O)c1ccc(OC2CCN(CC2)C(C)C)c(C)c1
CC(C)N1CCC(CC1)Oc1ccc(cc1C)C(=O)NC1CCN(C1)C1CCC1
CC(C)N1CCC(CC1)Oc1ccc2C(=O)N(CCc2c1)C1CCN(C1)C1CCC1
CC(C)N1CCC(CC1)Oc1ccc2C(=O)N(CCc2c1)C1CCN(CC1)C1CCC1
O=C1N(CCc2cc(OC3CCN(CC3)C3CCC3)ccc12)C1CCN(CC1)C1CCC1
CC(C)N1CCC(C1)NC(=O)c1ccc(OC2CCN(CC2)C(C)C)cc1
CC(C)N1CCC(C1)NC(=O)c1ccc(OC2CCN(CC2)C2CCC2)cc1
CC(C)N1CCC(C1)NC(=O)c1ccc(OC2CCN(CC2)C2CCCC2)cc1
CC(C)CN1CCC(C1)NC(=O)c1ccc(OC2CCN(CC2)C(C)C)cc1
CC(C)N1CCC(C1)N1CCc2cc(OC3CCN(CC3)C(C)C)ccc2C1=O
O=C(N1CCN(CC1)C1CC1)c1ccc(CN2CCOCC2)cc1
O=C1CCCN1c1ccc(Oc2ccc3CCN(CCc3c2)C2CCC2)nc1
N#Cc1ccc(OCCCN2CCCCC2)cc1
C(Oc1ccc(CN2CCCCC2)cc1)c1ccc(CN2CCCCC2)cc1
FC1(F)CCN(CCCOc2ccc(cc2)C#N)CC1
FCc1ccc(OCCCN2CCCCC2)cc1
FCCc1ccc(OCCCN2CCCCC2)cc1
F[C@H]1CCN(Cc2ccc(OCCCN3CCCCC3)cc2)C1 |r|
F[C@@H]1CCN(Cc2ccc(OCCCN3CCCCC3)cc2)C1 |r|
FC1CCN(Cc2ccc(OCCCN3CCCC3)cc2)CC1
F[C@@H]1CCN(Cc2ccc(OCCCN3CCCC3)cc2)C1 |r|
FC1CCN(CCCOc2ccc(CN3CCCC3)cc2)CC1
FC1(F)CCN(Cc2ccc(OCCCN3CCCCC3)cc2)CC1
BrC1CCN(Cc2ccc(OCCCN3CCCCC3)cc2)CC1
ClC1CCN(Cc2ccc(OCCCN3CCCCC3)cc2)CC1
Cc1ccc2[nH]cc(CCN(CC=C)CC=C)c2c1
COc1ccc2[nH]cc(CCN(CC=C)CC=C)c2c1
Clc1ccc2[nH]cc(CCN(CC=C)CC=C)c2c1
Brc1ccc2[nH]cc(CCN(CC=C)CC=C)c2c1
C=CCN(CCc1c[nH]c2ccccc12)CC=C
Fc1ccc2[nH]cc(CCN(CC=C)CC=C)c2c1
COc1c(OCCF)cccc1C(O)C1CCN(CCc2ccc(F)cc2)CC1
COc1c(OCCF)cccc1[C@H](O)C1CCN(CCc2ccc(F)cc2)CC1 |r|
COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
COc1c(OCCF)cccc1C(O)C1CCN(CCc2ccc(C)cc2)CC1
COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(C)cc2)CC1
C(Cc1cnc[nH]1)SC1=NCCN1 |t:9|
CNC(SCCc1cnc[nH]1)=NC |w:11.12|
CN=C(N)SCCc1cnc[nH]1 |w:1.0|
C[C@H](CN)c1cnc[nH]1 |r|
CN(C)C(=N)SCCc1cnc[nH]1
C(CC1CCCNC1)Cc1c[nH]cn1
C(Cc1c[nH]cn1)C1CCCNC1
C(C1CCCNC1)c1c[nH]cn1
C(CC1CCNCC1)Cc1cnc[nH]1
C(Cc1cnc[nH]1)C1CCNCC1
C(C1CCNCC1)c1c[nH]cn1
COc1ccc(cc1)-c1nnc(o1)C(=O)N1CC(C1)Oc1ccc(CN2CC3(COC3)C2)cc1
N#C\N=C(\NCCSc1ccccc1)NC[C@H]1CC[C@@H](C1)c1c[nH]cn1 |r|
N#C\N=C(\NCCSc1ccccc1)NC[C@@H]1CC[C@H](C1)c1c[nH]cn1 |r|
N#C\N=C(\NCCSc1ccccc1)NC[C@H]1CC[C@H](C1)c1c[nH]cn1 |r|
N#C\N=C(\NCCSc1ccccc1)NC[C@@H]1CC[C@@H](C1)c1c[nH]cn1 |r|
N#CNC(NCCSc1ccccc1)=NCCCCc1cnc[nH]1 |w:14.15|
CN\C(NC[C@H]1CC[C@@H](C1)c1c[nH]cn1)=N/C#N |r|
CN\C(NC[C@@H]1CC[C@@H](C1)c1c[nH]cn1)=N/C#N |r|
N#C\N=C(/NC[C@H]1CC[C@@H](C1)c1c[nH]cn1)NC1CC1 |r|
N#C\N=C(/NC[C@@H]1CC[C@@H](C1)c1c[nH]cn1)NC1CC1 |r|
CC(C)CN\C(NC[C@H]1CC[C@@H](C1)c1c[nH]cn1)=N\C#N |r|
CC(C)CN\C(NC[C@@H]1CC[C@@H](C1)c1c[nH]cn1)=N\C#N |r|
Cc1nc[nH]c1CCN
CC(=N)SCCNC(N)=N
CN\C(NC[C@@H]1CC[C@H](C1)c1c[nH]cn1)=N/C#N |r|
C\N=C(\NC[C@H]1CC[C@@H](O1)c1c[nH]cn1)NC#N
NCCCCc1c[nH]cn1
CN\C(NC[C@H]1CC[C@H](C1)c1c[nH]cn1)=N/C#N |r|
COC1=C(Br)C(O)C2(CC(=NO2)C(=O)NCCc2cnc[nH]2)C=C1Br |c:2,9,24|
CCN1CCOC(COc2ccc(CN3CCOCC3)cc2)C1
C(Oc1ccc(CN2CCOCC2)cc1)C1CN(CCO1)C1CC1
CN1CCOC(COc2ccc(CN3CCOCC3)cc2)C1
CC(C)N1CCOC(COc2ccc(CN3CCOCC3)cc2)C1
C(Oc1ccc(CN2CCOCC2)cc1)C1CN(CCO1)C1CCC1
C(Oc1ccc(CN2CCOCC2)cc1)C1CN(CCO1)C1CCCC1
C(Oc1cccc(CN2CCOCC2)c1)C1CN(CCO1)C1CC1
CC(C)N1CCOC(COc2cccc(CN3CCOCC3)c2)C1
C(Oc1cccc(CN2CCOCC2)c1)C1CN(CCO1)C1CCC1
C(Oc1ccccc1)C1CNCCO1
CC(C)N1CCOC(COc2ccccc2)C1
CCOc1ccccc1OCC1CN(CCO1)C(C)C
CCOc1ccccc1OCC1CN(CCO1)C1CCC1
CCOc1ccccc1OCC1CN(CCO1)C1CC1
CCOc1ccccc1OCC1CN(CCO1)C1CCCC1
C(Oc1ccc(CN2CCCC2)cc1)C1CN(CCO1)C1CCCC1
C(Oc1ccc(CN2CCCCC2)cc1)C1CN(CCO1)C1CCCC1
C(Oc1ccc(CN2CCOCC2)cc1)[C@H]1CN(CCO1)C1CCCC1 |r|
C(Oc1ccc(CN2CCOCC2)cc1)[C@@H]1CN(CCO1)C1CCCC1 |r|
CN(C)CCOc1ccc(CCNC(=O)c2cc(Br)c[nH]2)cc1Br
Brc1c[nH]c(c1)C(=O)NCCc1ccc(OCCN2CCCC2)c(Br)c1
Brc1c[nH]c(c1)C(=O)NCCc1ccc(OCCN2CCOCC2)c(Br)c1
CN1CCCC(COc2ccc(CCNC(=O)c3cc(Br)c[nH]3)cc2Br)C1
CN(C)CCCOc1ccc(CCNC(=O)c2ccc[nH]2)cc1Br
CN(C)CCOc1ccc(CCNC(=O)c2ccc[nH]2)cc1Br
Brc1cc(CCNC(=O)c2ccc[nH]2)ccc1OCCN1CCCC1
Brc1cc(CCNC(=O)c2ccc[nH]2)ccc1OCCN1CCOCC1
CN1CCCC(COc2ccc(CCNC(=O)c3ccc[nH]3)cc2Br)C1
CN(C)CCCOc1ccc(CCNC(=O)c2cccn2C)cc1Br
CN(C)CCOc1ccc(CCNC(=O)c2cccn2C)cc1Br
Cn1cccc1C(=O)NCCc1ccc(OCCN2CCCC2)c(Br)c1
Cn1cccc1C(=O)NCCc1ccc(OCCN2CCOCC2)c(Br)c1
CN1CCCC(COc2ccc(CCNC(=O)c3cccn3C)cc2Br)C1
CN(C)CCCOc1ccc(CCNC(=O)c2cc(Br)cs2)cc1Br
CN(C)CCOc1ccc(CCNC(=O)c2cc(Br)cs2)cc1Br
Brc1csc(c1)C(=O)NCCc1ccc(OCCN2CCCC2)c(Br)c1
Brc1csc(c1)C(=O)NCCc1ccc(OCCN2CCOCC2)c(Br)c1
CN1CCCC(COc2ccc(CCNC(=O)c3cc(Br)cs3)cc2Br)C1
CN(C)CCCOc1ccc(CCNC(=O)c2ccc(Br)o2)cc1Br
CN(C)CCOc1ccc(CCNC(=O)c2ccc(Br)o2)cc1Br
Brc1ccc(o1)C(=O)NCCc1ccc(OCCN2CCCC2)c(Br)c1
Brc1ccc(o1)C(=O)NCCc1ccc(OCCN2CCOCC2)c(Br)c1
CN1CCCC(COc2ccc(CCNC(=O)c3ccc(Br)o3)cc2Br)C1
CC1CCCN1CCOc1ccc(CCNC(=O)c2cc(Br)cs2)cc1Br
FC1CCN(CCOc2ccc(CCNC(=O)c3cc(Br)cs3)cc2Br)C1
FC(F)(F)c1cccc(n1)C(=O)NCCc1ccc(OCCN2CCCC2)c(Br)c1
Brc1cc(CCNC(=O)c2cnco2)ccc1OCCN1CCCC1
Brc1cc(CCNC(=O)c2nnc[nH]2)ccc1OCCN1CCCC1
Brc1cc(CCNC(=O)c2nccs2)ccc1OCCN1CCCC1
Brc1cc(CCNC(=O)c2cncs2)ccc1OCCN1CCCC1
Clc1cccc(c1)C(=O)NCCc1ccc(OCCN2CCCC2)c(Br)c1
Brc1cccc(c1)C(=O)NCCc1ccc(OCCN2CCCC2)c(Br)c1
FC(F)(F)c1cccc(c1)C(=O)NCCc1ccc(OCCN2CCCC2)c(Br)c1
CN1C[C@H]2CCN([C@H]2C1)c1ccc2cc(ccc2c1)-c1ccc(cc1)C#N |r|
CN1C[C@H]2CCN([C@H]2C1)c1ccc2cc(ccc2c1)-c1ccc(F)cc1 |r|
CN1C[C@H]2CC[C@H]3c4ccc(cc4CC[C@]23C1)-c1cccc(c1)C(C)=O |r|
CN1C[C@H]2CC[C@@H]3c4ccc(cc4CC[C@]23C1)-c1cccc(c1)C(C)=O |r|
CN1C[C@H]2CC[C@@H]3c4ccc(cc4CC[C@]23C1)-c1ccc(cc1)C#N |r|
CN1C[C@H]2CCN([C@H]2C1)c1ccc(cc1)-c1ccc(cc1)C#N |r|
CCN1C[C@H]2CCN([C@H]2C1)c1ccc(cc1)-c1ccc(cc1)C#N |r|
CC(C)N1C[C@H]2CCN([C@H]2C1)c1ccc(cc1)-c1ccc(cc1)C#N |r|
N#Cc1ccc(cc1)-c1ccc(cc1)N1CC[C@@H]2CN(CC3CC3)C[C@H]12 |r|
CCCN1C[C@H]2CCN([C@H]2C1)c1ccc(cc1)-c1ccc(cc1)C#N |r|
CN1C[C@@H]2CCN([C@@H]2C1)c1ccc(cc1)-c1ccc(cc1)C#N |r|
CN1CC[C@@H]2CN(C[C@H]12)c1ccc(cc1)-c1ccc(cc1)C#N |r|
CN1CC[C@H]2CN(C[C@@H]12)c1ccc(cc1)-c1ccc(cc1)C#N |r|
CN1C[C@H]2CN([C@H]2C1)c1ccc(cc1)-c1ccc(cc1)C#N |r|
CN1C[C@@H]2CN([C@@H]2C1)c1ccc(cc1)-c1ccc(cc1)C#N |r|
CN1C[C@@H]2CN(C[C@H]12)c1ccc(cc1)-c1ccc(cc1)C#N |r|
CN1C[C@H]2CCN([C@H]2C1)c1ccc(Br)cc1 |r|
CN1C[C@H]2CCN([C@H]2C1)c1ccc(cc1)-c1ccccc1 |r|
CN1C[C@H]2CCN([C@H]2C1)c1cccc(c1)-c1ccccc1 |r|
CN1C[C@H]2CCN([C@H]2C1)c1ccc(Cc2ccccc2)cc1 |r|
CN1C[C@H]2CCN([C@H]2C1)c1ccc(Oc2ccccc2)cc1 |r|
CN1C[C@H]2CCN([C@H]2C1)c1ccc(cc1)-c1ccc(cc1)C(C)=O |r|
CN1C[C@H]2CCN([C@H]2C1)c1ccc(cc1)-c1cccc(c1)C(C)=O |r|
CN1C[C@H]2CCN([C@H]2C1)c1ccc(cc1)-c1cccc(c1)C#N |r|
CN1C[C@H]2CCN([C@H]2C1)c1ccc(cc1)-c1ccc(F)cc1 |r|
CN1C[C@H]2CCN([C@H]2C1)c1ccc(cc1)-c1ccc(Br)cc1 |r|
COc1ccc(cc1)-c1ccc(cc1)N1CC[C@@H]2CN(C)C[C@H]12 |r|
CN1C[C@H]2CCN([C@H]2C1)c1ccc2cc(Br)ccc2c1 |r|
N#Cc1ccc(cc1)-c1ccc(cc1)N1CC[C@@H]2CNC[C@H]12 |r|
CC(C)CN1C[C@H]2CCN([C@H]2C1)c1ccc(cc1)-c1ccc(cc1)C#N |r|
CCCCN1C[C@H]2CCN([C@H]2C1)c1ccc(cc1)-c1ccc(cc1)C#N |r|
COc1cccc2OC(C(C)S(=O)(=O)c12)c1ccc(OCCCN2CCCC2)cc1
COc1ccc2OC(C(C)S(=O)(=O)c2c1)c1ccc(OCCCN2CCCC2)cc1
COc1ccc2c(OC(C(C)S2(=O)=O)c2ccc(OCCCN3CCCC3)cc2)c1
COc1cccc2c1O[C@H]([C@H](C)S2(=O)=O)c1ccc(OCCCN2CCCC2)cc1 |r|
COc1cccc2c1OC(C(C)S2(=O)=O)c1ccc(OCCCN2CCCCC2)cc1
COc1cccc2c1OC(C(C)S2(=O)=O)c1ccc(OCCCN2CCC[C@H]2C)cc1 |r|
COc1cccc2c1OC(C(C)S2(=O)=O)c1ccc(OCCCN2CCC[C@@H]2C)cc1 |r|
COc1cccc2c1OC(C(C)S2(=O)=O)c1ccc(OCCCN2CCC[C@H](C)C2)cc1 |r|
COc1cccc2c1OC(C(C)S2(=O)=O)c1ccc(OC2CCN(CC2)C2CCC2)cc1
COc1cccc2c1O[C@@H]([C@@H](C)S2(=O)=O)c1ccc(OCCCN2CCCC2)cc1 |r|
CC1C(Oc2ccccc2S1(=O)=O)c1ccc(OCCCN2CCCC2)cc1
C[C@@H]1Sc2ccccc2O[C@@H]1c1ccc(OCCCN2CCCC2)cc1 |r|
CC[C@@H]1Sc2ccccc2O[C@@H]1c1ccc(OCCCN2CCCC2)cc1 |r|
C(COc1ccc(cc1)[C@H]1Oc2ccccc2S[C@H]1c1ccccc1)CN1CCCC1 |r|
C[C@H]1Sc2ccccc2O[C@@H]1c1ccc(OCCCN2CCCC2)cc1 |r|
CC1=C(Oc2ccccc2S1)c1ccc(OCCCN2CCCC2)cc1 |t:1|
C[C@H]1[C@H](Oc2ccccc2S1(=O)=O)c1ccc(OCCCN2CCCC2)cc1 |r|
C[C@@H]1[C@H](Oc2ccccc2S1(=O)=O)c1ccc(OCCCN2CCCC2)cc1 |r|
CC1=C(Oc2ccccc2S1(=O)=O)c1ccc(OCCCN2CCCC2)cc1 |t:1|
CCNS(=O)(=O)c1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NC1CCOCC1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)N1CCOCC1 |r|
COCCNS(=O)(=O)c1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
COC1CCN(CC1)C(=O)c1ccc2cc(OC3CCN(CC3)C(C)C)ccc2c1
CC(C)N1CCC(CC1)Oc1ccc2cc(ccc2c1)C(=O)N1CCOCC1
CC1CCN(CC1)C(=O)c1ccc2cc(OCCCN3CCCCC3)ccc2n1
COC1CCN(CC1)C(=O)c1ccc2cc(OC3CCN(CC3)C(C)C)ccc2n1
CC(C)N1CCC(CC1)Oc1ccc2nc(ccc2c1)C(=O)N1CCOCC1
O=C(N1CCC1)c1ccc2cc(OCCCN3CCCCC3)ccc2n1
CC(C)N1CCC(CC1)Oc1ccc2nc(ccc2c1)C(=O)N1CCC1
CC1CCN(CC1)C(=O)c1ccc2cc(OCCCN3CCCCC3)ccc2c1
CC(C)CN1CCC(CC1)Oc1ccc2cc(ccc2c1)C(=O)N1CCC(C)CC1
CC1CCN(CC1)C(=O)c1ccc2cc(OCCC3CCCN3C)ccc2c1
CC(C)N1CCC(C1)Oc1ccc2cc(ccc2c1)C(=O)N1CCC(C)CC1
CC(C)N1CCC(CC1)Oc1ccc2cc(ccc2c1)C(=O)N1CCC(C)CC1
CC1CCN(CC1)C(=O)c1ccc2cc(OCCCN3CCOCC3)ccc2c1
OCC1CCN(CC1)C(=O)c1ccc2cc(OCCCN3CCCCC3)ccc2c1
COC1CCN(CC1)C(=O)c1ccc2cc(OCCCN3CCCCC3)ccc2c1
CC(C)N1CCC(CC1)Oc1ccc2cc(ccc2c1)C(=O)N1CCCC1C
CC(C)N1CCC(CC1)Oc1ccc2cc(ccc2c1)C(=O)N1CCC(CO)CC1
CC(C)N1CCC(CC1)Oc1ccc2nc(ccc2c1)C(=O)N1CCC[C@H]1C#N |r|
CC(C)N1[C@@H]2C[C@H]1CC(CC2)Oc1ccc2nc(ccc2c1)C(=O)N1CCOCC1 |r,TLB:1:3:8.9.10.7:5|
Cc1ncc(cc1NC(=O)c1cnn2cc(ccc12)-c1cnn(C)c1)C(=O)NCCN1CCCC1(C)C
CNCCN1CCC(CC1)OCc1ccccc1
C(COC(c1ccccc1)c1ccccc1)Cc1c[nH]cn1
Cn1cnc(CCN)c1
C(COC(c1nc2ccccc2s1)c1ccccc1)Cc1c[nH]cn1
Clc1ccc2nc(sc2n1)N1CCC(CC1)N1CCCCC1
C1CCN(CC1)C1CCN(CC1)c1nc2ncccc2s1
Nc1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
N#Cc1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
Clc1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
CC(=O)Nc1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
C1CCN(CC1)C1CCN(CC1)c1nc2cnccc2s1
Nc1cc2sc(nc2cn1)N1CCC(CC1)N1CCCCC1
N#Cc1cc2sc(nc2cn1)N1CCC(CC1)N1CCCCC1
Clc1cc2sc(nc2cn1)N1CCC(CC1)N1CCCCC1
CC(=O)Nc1cc2sc(nc2cn1)N1CCC(CC1)N1CCCCC1
N#Cc1ccc(cc1)-c1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
Fc1ccc(cc1C#N)-c1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
CC(=O)c1cccc(c1)-c1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
COc1cccc(c1)-c1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
Oc1ccc(cc1)-c1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
N#Cc1ccc(cc1)-c1cc2sc(nc2cn1)N1CCC(CC1)N1CCCCC1
Fc1ccc(cc1C#N)-c1cc2sc(nc2cn1)N1CCC(CC1)N1CCCCC1
CC(=O)c1cccc(c1)-c1cc2sc(nc2cn1)N1CCC(CC1)N1CCCCC1
COc1cccc(c1)-c1cc2sc(nc2cn1)N1CCC(CC1)N1CCCCC1
Oc1ccc(cc1)-c1cc2sc(nc2cn1)N1CCC(CC1)N1CCCCC1
Fc1ccc(cn1)-c1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
Fc1cc(ccn1)-c1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
Fc1ncccc1-c1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
N#Cc1cncc(c1)-c1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
COc1ccc(cn1)-c1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
COc1cc(ccn1)-c1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
Cc1ccc(cn1)-c1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
O=c1ccc(c[nH]1)-c1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
Nc1ccc(cn1)-c1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
CC(=O)Nc1ccc(cn1)-c1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
C1CCN(CC1)C1CCN(CC1)c1nc2ncc(cc2s1)-c1cncnc1
Nc1cnc(cn1)-c1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
Fc1ccc(cn1)-c1cc2sc(nc2cn1)N1CCC(CC1)N1CCCCC1
Fc1cc(ccn1)-c1cc2sc(nc2cn1)N1CCC(CC1)N1CCCCC1
Fc1ncccc1-c1cc2sc(nc2cn1)N1CCC(CC1)N1CCCCC1
N#Cc1cncc(c1)-c1cc2sc(nc2cn1)N1CCC(CC1)N1CCCCC1
COc1ccc(cn1)-c1cc2sc(nc2cn1)N1CCC(CC1)N1CCCCC1
COc1cc(ccn1)-c1cc2sc(nc2cn1)N1CCC(CC1)N1CCCCC1
Cc1ccc(cn1)-c1cc2sc(nc2cn1)N1CCC(CC1)N1CCCCC1
O=c1ccc(c[nH]1)-c1cc2sc(nc2cn1)N1CCC(CC1)N1CCCCC1
Nc1ccc(cn1)-c1cc2sc(nc2cn1)N1CCC(CC1)N1CCCCC1
CC(=O)Nc1ccc(cn1)-c1cc2sc(nc2cn1)N1CCC(CC1)N1CCCCC1
C1CCN(CC1)C1CCN(CC1)c1nc2cnc(cc2s1)-c1cncnc1
Nc1cnc(cn1)-c1cc2sc(nc2cn1)N1CCC(CC1)N1CCCCC1
Brc1cnc2nc(sc2c1)N1CCC(CC1)N1CCCCC1
[H][C@]12CCN(C)[C@]3([H])CCC[C@]([H])([C@@H](Cc4ccccc4)C(=O)C1)[C@@]23[H] |r|
[H][C@@]12CCC[C@@]3([H])N(CCC)CC[C@@]([H])(c4cc5ccc(cc5nc4[C@@H]1CC)C(F)(F)F)[C@]23[H] |r|
Clc1ccc(Cc2nn(C[C@H]3CCCN3CCCCc3ccc(OCCCN4CCCCCC4)cc3)c(=O)c3ccccc23)cc1 |r|
CCc1cc(N2CCN(CCc3ccc(OCCCN4CCCCCC4)cc3)CC2)c2nc(CCC(O)=O)ccc2c1
CCCCc1cc(N2CCN(CCc3ccc(OCCCN4CCCCCC4)cc3)CC2)c2nc(CCC(O)=O)ccc2c1
OC(=O)CCc1ccc2cc(Cc3ccccc3)cc(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)c2n1
C(COc1ccc(CCN2CCN(CC2)c2cccc3cccnc23)cc1)CN1CCCCCC1
OC(=O)c1cnc2c(cccc2c1)N1CCN(CCc2ccc(OCCCN3CCCCCC3)cc2)CC1
OC(=O)c1cc(N2CCN(CCc3ccc(OCCCN4CCCCCC4)cc3)CC2)c2ncccc2c1
OC(=O)c1ccc2cccnc2c1N1CCN(CCc2ccc(OCCCN3CCCCCC3)cc2)CC1
C(CCc1ccc(OCCCN2CCCCCC2)cc1)CN1CCN(CC1)c1cccc2cccnc12
CN1CCCC(CC1)n1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O
N#Cc1ccc(N2CCN(CCc3ccc(OCCCN4CCCCCC4)cc3)CC2)c2ncccc12
OC(=O)c1ccc2cccc(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)c2n1
C(COc1ccc(CCCN2CCN(CC2)c2cccc3cccnc23)cc1)CN1CCCCCC1
OC(=O)\C=C\c1ccc2cccc(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)c2n1
OC(=O)CCc1cnc2c(cccc2c1)N1CCN(CCc2ccc(OCCCN3CCCCCC3)cc2)CC1
OC(=O)CCc1ccc2cccc(N3CCN(CCc4ccc(OCCCN5CCCCCC5)cc4)CC3)c2n1
OC(=O)c1ccnc2c(cccc12)N1CCN(CCc2ccc(OCCCN3CCCCCC3)cc2)CC1
CCCNCc1ccc(CCn2ccc(OCc3ccc(F)cc3)cc2=O)cc1
CCCNCc1ccc(CCn2ccc(OCc3ccc(F)cc3)cc2=O)nc1
Clc1cccc2ccn(Cc3ccc(cc3)C(=O)N3CC[C@@H](C3)N3CCCC3)c12 |r|
CN(C)C1CCN(C1)C(=O)c1ccc(Cn2c(nc3ccccc23)-c2ccccc2)cc1
CCN(C)C1CCN(C1)C(=O)c1ccc(Cn2c(nc3ccccc23)-c2ccccc2)cc1
O=C(N1CCC(C1)N1CCCC1)c1ccc(Cn2c(nc3ccccc23)-c2ccccc2)cc1
CN(CCO)C1CCN(C1)C(=O)c1ccc(Cn2c(nc3ccccc23)-c2ccccc2)cc1
CN(C)[C@H]1CCN(C1)C(=O)c1ccc(Cn2c(nc3ccccc23)-c2ccccc2)cc1 |r|
CN(C)[C@@H]1CCN(C1)C(=O)c1ccc(Cn2c(nc3ccccc23)-c2ccccc2)cc1 |r|
CN(C)C1CCN(C1)C(=O)c1ccc(Cn2c(nc3ccccc23)-c2ccccn2)cc1
CN(C)C1CCN(C1)C(=O)c1ccc(Cn2cnc3ccccc23)cc1
CN(C)C1CCN(C1)C(=O)c1ccc(Cn2c(C)nc3ccccc23)cc1
O=C(N1CCC(C1)N1CCCC1)c1ccc(Cn2cnc3ccccc23)cc1
O=C(N1CC[C@@H](C1)N1CCCC1)c1ccc(Cn2cnc3ccccc23)cc1 |r|
O=C(N1CC[C@H](C1)N1CCCC1)c1ccc(Cn2cnc3ccccc23)cc1 |r|
Cc1nc2ccccc2n1Cc1ccc(cc1)C(=O)N1CC[C@@H](C1)N1CCCC1 |r|
Cc1nc2ccccc2n1Cc1ccc(cc1)C(=O)N1CC[C@H](C1)N1CCCC1 |r|
O=C(N1CCC(C1)N1CCCC1)c1cccc(Cn2cnc3ccccc23)c1
O=C(N1CCC(C1)N1CCCC1)c1ccccc1Cn1cnc2ccccc12
O=C(N1CC[C@@H](C1)N1CCCC1)c1ccc(Cn2ccc3ccccc23)cc1 |r|
Clc1ccc2ccn(Cc3ccc(cc3)C(=O)N3CC[C@@H](C3)N3CCCC3)c2c1 |r|
Clc1ccc2n(Cc3ccc(cc3)C(=O)N3CC[C@@H](C3)N3CCCC3)ccc2c1 |r|
Cc1nc[nH]c1[C@@H]1C[C@H]1CNCc1ccc(Cl)cc1 |r|
Cc1nc[nH]c1[C@@H]1C[C@H]1CCNCc1ccc(Cl)cc1 |r|
CC[C@@H](C)NC(=O)OCCCc1cnc[nH]1 |r|
CC[C@H](C)NC(=O)OCCCc1cnc[nH]1 |r|
CCC[C@@H](C)NC(=O)OCCCc1cnc[nH]1 |r|
CC[C@H](C)CNC(=O)OCCCc1cnc[nH]1 |r|
CCCC[C@@H](C)NC(=O)OCCCc1cnc[nH]1 |r|
CCCC[C@H](C)NC(=O)OCCCc1cnc[nH]1 |r|
CCCCC[C@@H](C)NC(=O)OCCCc1cnc[nH]1 |r|
CCCCC[C@H](C)NC(=O)OCCCc1cnc[nH]1 |r|
CC(C)CCCC(C)NC(=O)OCCCc1cnc[nH]1
CC(C)CCCNC(=O)OCCCc1cnc[nH]1
CC(C)CCC(C)NC(=O)OCCCc1cnc[nH]1
CCCCC(CC)CNC(=O)OCCCc1cnc[nH]1
CCCCCC[C@@H](C)NC(=O)OCCCc1cnc[nH]1 |r|
CCCCCC[C@H](C)NC(=O)OCCCc1cnc[nH]1 |r|
Fc1ccc(CNC(=O)N(C2CCN(Cc3ccnnc3)CC2)c2ccc(Cl)cc2)cc1
Brc1ccc(cc1)N(C1CCN(Cc2ccncc2)CC1)C(=O)NCc1ccccc1
Brc1ccc(cc1)N(C1CCN(Cc2ccnnc2)CC1)C(=O)NCc1ccccc1
Brc1ccc(cc1)N(C1CCN(CC1)C1CCCC1)C(=O)Nc1ccccc1
Fc1ccc(CNC(=O)N(C2CCN(CC2)C2CCCC2)c2ccc(Br)cc2)cc1
CCN1CCC(CC1)N(C(=O)NCc1ccc(Cl)c(Cl)c1)c1ccc(Br)cc1
CCN1CCC(CC1)N(C(=O)NCc1ccc(F)cc1)c1ccc(Cl)cc1
CCN1CCC(CC1)N(C(=O)NCc1ccc(F)cc1)c1ccc(Cl)cn1
CCN1CCC(CC1)N(C(=O)NCc1ccc(F)cc1)c1ccc(F)cc1
Fc1ccc(CNC(=O)N(C2CCN(CC2)C2CCCC2)c2ccccc2)cc1
CCN1CCC(CC1)N(C(=O)NCc1ccc(F)cc1)c1ccc(CO)cc1
CCN1CCC(CC1)N(Cc1ccc(Br)cc1)C(=O)NCc1ccc(F)cc1
CCN1CCC(CC1)N(C1CCNCC1)C(=O)NCc1ccc(F)cc1
CCN1CCC(CC1)N(C1CCN(CCO)CC1)C(=O)NCc1ccc(F)cc1
Fc1ccc(CNC(=O)N(C2CCNCC2)c2ccc(Cl)cc2)cc1
CS(=O)(=O)N1CCC(CC1)N(C(=O)NCc1ccc(F)cc1)c1ccc(Cl)cc1
OCCN1CCC(CC1)N(C(=O)NCc1ccc(F)cc1)c1ccc(Cl)cc1
OCCN1CCC(CC1)N(C(=O)NCc1ccc(F)cc1)c1ccc(Br)cc1
OCC(O)CN1CCC(CC1)N(C(=O)NCc1ccc(F)cc1)c1ccc(Cl)cc1
CCNC(=O)N1CCC(CC1)N(C(=O)NCc1ccc(F)cc1)c1ccc(Cl)cc1
Fc1ccc(CNC(=O)N(C2CCN(Cc3ccccn3)CC2)c2ccc(Cl)cc2)cc1
Fc1ccc(CNC(=O)N(C2CCN(Cc3ccncc3)CC2)c2ccc(Cl)cc2)cc1
Fc1ccc(CNC(=O)N(C2CCN(Cc3cc[nH]c(=O)c3)CC2)c2ccc(Cl)cc2)cc1
Nc1cc(CN2CCC(CC2)N(C(=O)NCc2ccc(F)cc2)c2ccc(Cl)cc2)ccn1
Clc1cc(Cl)cc(CNC(=O)N(C2CCN(CC2)C2CCCC2)c2ccc(Br)cc2)c1
Clc1ccc(CNC(=O)N(C2CCN(CC2)C2CCCC2)c2ccc(Br)cc2)cc1Cl
COc1ccc(CNC(=O)N(C2CCN(CC2)C2CCCC2)c2ccc(Br)cc2)cc1
Brc1ccc(cc1)N(C1CCN(CC1)C1CCCC1)C(=O)NCc1ccccc1
C[S+]([O-])c1ccc(Cc2noc(CCc3c[nH]cn3)n2)cc1
Ic1ccc(Cc2noc(CCc3c[nH]cn3)n2)cc1
Fc1ccc(Cc2noc(CCc3c[nH]cn3)n2)cc1
Clc1ccc(CCc2noc(Cc3c[nH]cn3)n2)cc1
C(Cc1nc(Cc2ccc(cc2)-c2ccccc2)no1)c1c[nH]cn1
CS(=O)(=O)Nc1ccc(Cc2noc(CCc3c[nH]cn3)n2)cc1
Cn1nc(CCc2c[nH]cn2)nc1Cc1ccc(Cl)cc1
Clc1ccc(Cc2n[nH]c(CCCc3c[nH]cn3)n2)cc1
Clc1ccc(CNC(=N)SCCCc2c[nH]cn2)cc1
Clc1ccc(Cc2noc(CCc3c[nH]cn3)n2)cc1Cl
Clc1ccc(Cc2noc(CCCc3cnc[nH]3)n2)cc1
Clc1ccc(CCc2noc(CCc3c[nH]cn3)n2)cc1
Clc1ccc(Cc2n[nH]c(CCc3c[nH]cn3)n2)cc1
FC(F)(F)c1ccc(Cc2noc(CCc3c[nH]cn3)n2)cc1
Clc1ccc(Cc2nc(CCc3c[nH]cn3)no2)cc1
Clc1ccc(Cc2csc(CCc3c[nH]cn3)n2)cc1
CSc1ccc(Cc2noc(CCc3c[nH]cn3)n2)cc1
Clc1ccc(Cc2noc(Cc3c[nH]cn3)n2)cc1
CS(=O)(=O)c1ccc(Cc2noc(CCc3c[nH]cn3)n2)cc1
Clc1ccc(Cc2nnc(CCc3c[nH]cn3)s2)cc1
COc1ccc(Cc2noc(CCc3c[nH]cn3)n2)cc1
Cc1ccc(cc1)S(=O)(=O)NCCCCc1cnc[nH]1
[O-][N+](=O)c1ccc(cc1)S(=O)(=O)NCCCCCc1cnc[nH]1
Clc1cccc(c1)S(=O)(=O)NCCCCc1cnc[nH]1
O=C([C@@H]1C[C@@H](CN1)Oc1ccc(cc1)C#N)N1CCCN(CC1)C1CCC1 |r|
CSc1ccc(O[C@H]2C[C@H](N(C2)C(C)=O)C(=O)N2CCCN(CC2)C2CCC2)cc1 |r|
CC(=O)N1C[C@H](C[C@H]1C(=O)N1CCCN(CC1)C1CCC1)Oc1cccc(F)c1 |r|
Fc1ccc(O[C@H]2C[C@H](N(C2)C2CC2)C(=O)N2CCCN(CC2)C2CCC2)cc1 |r|
Fc1cccc(O[C@H]2CN[C@@H](C2)C(=O)N2CCCN(CC2)C2CCC2)c1 |r|
O=C([C@@H]1C[C@H](CN1)Oc1ccc(cc1)C#N)N1CCCN(CC1)C1CCC1 |r|
CSc1ccc(O[C@H]2CN[C@@H](C2)C(=O)N2CCCN(CC2)C2CCC2)cc1 |r|
CC(=O)N1C[C@@H](C[C@H]1C(=O)N1CCCN(CC1)C1CCC1)Oc1cccc(F)c1 |r|
Fc1cccc(O[C@H]2CN[C@H](C2)C(=O)N2CCCN(CC2)C2CCC2)c1 |r|
O=C([C@H]1C[C@H](CN1)Oc1ccc(cc1)C#N)N1CCCN(CC1)C1CCC1 |r|
CC(=O)N1C[C@@H](C[C@@H]1C(=O)N1CCCN(CC1)C1CCC1)Oc1cccc(F)c1 |r|
O=C([C@H]1C[C@@H](CN1)Oc1ccsc1)N1CCCN(CC1)C1CCC1 |r|
O=C([C@H]1C[C@@H](CN1)Oc1ccccn1)N1CCCN(CC1)C1CCC1 |r|
O=C([C@H]1C[C@@H](CN1)Oc1cccnc1)N1CCCN(CC1)C1CCC1 |r|
CC(=O)N1C[C@H](C[C@@H]1C(=O)N1CCCN(CC1)C1CCC1)Oc1cccs1 |r|
CC(=O)N1C[C@H](C[C@@H]1C(=O)N1CCCN(CC1)C1CCC1)Oc1ccsc1 |r|
CC(=O)N1C[C@H](C[C@@H]1C(=O)N1CCCN(CC1)C1CCC1)Oc1ccccn1 |r|
CC(=O)N1C[C@H](C[C@@H]1C(=O)N1CCCN(CC1)C1CCC1)Oc1cccnc1 |r|
Fc1ccc(C[C@@]2(CCCN2)C(=O)N2CCCN(CC2)C2CCC2)cc1 |r|
Fc1cccc(C[C@@]2(CCCN2)C(=O)N2CCCN(CC2)C2CCC2)c1 |r|
FC(F)(F)c1ccc(C[C@@]2(CCCN2)C(=O)N2CCCN(CC2)C2CCC2)cc1 |r|
O=C(N1CCCN(CC1)C1CCC1)[C@@]1(Cc2ccccc2)CCCN1 |r|
O=C([C@H]1C[C@H](Cc2ccccc2)CN1)N1CCCN(CC1)C1CCC1 |r|
Fc1cccc(C[C@@H]2CN[C@H](C2)C(=O)N2CCCN(CC2)C2CCC2)c1 |r|
Fc1ccc(C[C@@H]2CN[C@H](C2)C(=O)N2CCCN(CC2)C2CCC2)cc1 |r|
CC(=O)N1C[C@H](C[C@@H]1C(=O)N1CCCN(CC1)C1CCC1)Oc1cccc(F)c1 |r|
O=C([C@H]1C[C@@H](CN1)Oc1ccccc1)N1CCCN(CC1)C1CCC1 |r|
Cc1ccccc1O[C@@H]1CN[C@H](C1)C(=O)N1CCCN(CC1)C1CCC1 |r|
Cc1cccc(O[C@@H]2CN[C@H](C2)C(=O)N2CCCN(CC2)C2CCC2)c1 |r|
Cc1ccc(O[C@@H]2CN[C@H](C2)C(=O)N2CCCN(CC2)C2CCC2)cc1 |r|
Cc1cc(O[C@@H]2CN[C@H](C2)C(=O)N2CCCN(CC2)C2CCC2)ccc1Cl |r|
COc1cccc(O[C@@H]2CN[C@H](C2)C(=O)N2CCCN(CC2)C2CCC2)c1 |r|
CSc1ccc(O[C@@H]2CN[C@H](C2)C(=O)N2CCCN(CC2)C2CCC2)cc1 |r|
FC(F)(F)c1ccc(O[C@@H]2CN[C@H](C2)C(=O)N2CCCN(CC2)C2CCC2)cc1 |r|
Fc1cccc(O[C@@H]2CN[C@H](C2)C(=O)N2CCCN(CC2)C2CCC2)c1 |r|
Fc1ccc(O[C@@H]2CN[C@H](C2)C(=O)N2CCCN(CC2)C2CCC2)cc1 |r|
Clc1ccc(O[C@@H]2CN[C@H](C2)C(=O)N2CCCN(CC2)C2CCC2)cc1 |r|
Clc1cccc(O[C@@H]2CN[C@H](C2)C(=O)N2CCCN(CC2)C2CCC2)c1 |r|
O=C([C@H]1C[C@@H](CN1)Oc1ccc(cc1)C#N)N1CCCN(CC1)C1CCC1 |r|
Fc1ccc(O[C@@H]2CN[C@H](C2)C(=O)N2CCCN(CC2)C2CCCC2)cc1 |r|
O=C([C@H]1C[C@@H](CN1)Oc1ccc(cc1)C#N)N1CCCN(CC1)C1CCCC1 |r|
O=C([C@H]1C[C@@H](CN1)Oc1ccc(cc1)C#N)N1CCCN(CC1)C1CC1 |r|
CN1C[C@H](C[C@@H]1C(=O)N1CCCN(CC1)C1CCC1)Oc1ccc(F)cc1 |r|
CC(C)N1C[C@H](C[C@@H]1C(=O)N1CCCN(CC1)C1CCC1)Oc1ccc(F)cc1 |r|
Fc1ccc(O[C@H]2C[C@@H](N(C2)C2CC2)C(=O)N2CCCN(CC2)C2CCC2)cc1 |r|
Fc1ccc(O[C@H]2C[C@@H](N(C2)C2CCC2)C(=O)N2CCCN(CC2)C2CCC2)cc1 |r|
CC(=O)N1C[C@H](C[C@@H]1C(=O)N1CCCN(CC1)C1CCC1)Oc1ccc(F)cc1 |r|
CS(=O)(=O)N1C[C@H](C[C@@H]1C(=O)N1CCCN(CC1)C1CCC1)Oc1ccc(F)cc1 |r|
CC(=O)N1C[C@H](C[C@@H]1C(=O)N1CCCNCC1)Oc1cccc(F)c1 |r|
CN1CCCN(CC1)C(=O)[C@H]1C[C@@H](CN1C(C)=O)Oc1cccc(F)c1 |r|
CC(C)N1CCCN(CC1)C(=O)[C@H]1C[C@@H](CN1C(C)=O)Oc1cccc(F)c1 |r|
CC(C)CN1CCCN(CC1)C(=O)[C@H]1C[C@@H](CN1C(C)=O)Oc1cccc(F)c1 |r|
CCOC(=O)N1C[C@H](C[C@@H]1C(=O)N1CCCN(CC1)C1CCC1)Oc1cccc(F)c1 |r|
Fc1cccc(O[C@H]2C[C@@H](N(C2)C(=O)C2CC2)C(=O)N2CCCN(CC2)C2CCC2)c1 |r|
Fc1cccc(O[C@H]2C[C@@H](N(CC3CC3)C2)C(=O)N2CCCN(CC2)C2CCC2)c1 |r|
CC(=O)N1C[C@H](C[C@@H]1C(=O)N1CCCN(CC1)C1CCCC1)Oc1cccc(F)c1 |r|
CC(=O)N1C[C@H](C[C@@H]1C(=O)N1CCCN(CC1)C1CCCCO1)Oc1cccc(F)c1 |r|
CC(=O)N1C[C@H](C[C@@H]1C(=O)N1CCCN(Cc2ccccc2)CC1)Oc1cccc(F)c1 |r|
C(Cc1cnc[nH]1)Nc1ccc(cc1)C1CCCCC1
CC[C@@H](CNCc1ccc(Cl)cc1)[C@@H]1C[C@H]1c1cnc[nH]1 |r|
CC[C@H](CNCc1ccc(Cl)cc1)[C@@H]1C[C@H]1c1cnc[nH]1 |r|
CC[C@H](CNCc1ccc(Cl)cc1)[C@H]1C[C@@H]1c1cnc[nH]1 |r|
CC[C@@H](CNCc1ccc(Cl)cc1)[C@H]1C[C@@H]1c1cnc[nH]1 |r|
C[C@@H](N)Cc1c[nH]cn1 |r|
O=S(=O)(Cc1ccccc1)NCCc1c[nH]cn1
O=S(=O)(NCCCCCCCc1c[nH]cn1)c1ccc2ccccc2c1
O=S(=O)(NCCCCCCc1c[nH]cn1)c1ccc2ccccc2c1
O=S(=O)(NCCCCc1c[nH]cn1)c1ccc2ccccc2c1
O=S(=O)(Cc1ccc2ccccc2c1)NCCc1c[nH]cn1
O=S(=O)(NCCCCCc1c[nH]cn1)c1ccc2ccccc2c1
O=S(=O)(NCCCCCCCCc1c[nH]cn1)c1ccc2ccccc2c1
O=S(=O)(NCCc1c[nH]cn1)c1ccc2ccccc2c1
O=S(=O)(NCCc1c[nH]cn1)\C=C\c1ccccc1
C[C@H](Cc1c[nH]cn1)NS(=O)(=O)c1ccc2ccccc2c1
O=S(=O)(NCCCc1c[nH]cn1)c1ccc2ccccc2c1
O=S(=O)(CCC1CCCCC1)NCCc1c[nH]cn1
CS(=O)(=O)NCCc1c[nH]cn1
O=S(=O)(NCCCCCCCCCCc1c[nH]cn1)c1ccc2ccccc2c1
Clc1ccc(CS(=O)(=O)NCCCCCCCCCCc2c[nH]cn2)cc1
Clc1ccc(CNS(=O)(=O)NCCCCCCc2c[nH]cn2)cc1
Brc1ccc(CNS(=O)(=O)NCCCCc2c[nH]cn2)cc1
FC(F)(F)c1ccc(CNS(=O)(=O)NCCCCc2c[nH]cn2)cc1
Clc1ccc(CNS(=O)(=O)NCCCCCc2c[nH]cn2)cc1
Clc1ccc(CNS(=O)(=O)NCCCCc2c[nH]cn2)cc1
O=S(=O)(NCCCCc1c[nH]cn1)NCc1ccc(cc1)-c1ccccc1
Clc1ccc(CNS(=O)(=O)NCCCCCCCCc2c[nH]cn2)cc1
Ic1ccc(CNS(=O)(=O)NCCCCc2c[nH]cn2)cc1
Clc1ccc(CNS(=O)(=O)NCCCCCCCc2c[nH]cn2)cc1
Clc1ccc(CS(=O)(=O)NCCCCCCc2c[nH]cn2)cc1
Fc1ccc(CNS(=O)(=O)NCCCCc2c[nH]cn2)cc1
COc1ccc(CNS(=O)(=O)NCCCCc2c[nH]cn2)cc1
Clc1ccc(CNS(=O)(=O)NCCCCCCCCCCc2c[nH]cn2)cc1
Clc1ccc(CS(=O)(=O)NCCCCCCCCc2c[nH]cn2)cc1
Clc1ccc(CS(=O)(=O)NCCCCCc2c[nH]cn2)cc1
Clc1ccc(CS(=O)(=O)NCCCCc2c[nH]cn2)cc1
Clc1ccc(CS(=O)(=O)NCCCCCCCc2c[nH]cn2)cc1
Clc1ccc(CNS(=O)(=O)NCCCc2c[nH]cn2)cc1
Cc1cc(OCCCN2C[C@H]3CCCN[C@H]3C2)ccc1-c1nc2ccc(F)c(C)c2[nH]1 |r|
Cc1cc(OCCCNCCc2cnc[nH]2)ccc1-c1nc2ccc(F)c(C)c2[nH]1
Cc1cc(OCCCN2CCc3nc[nH]c3C2)ccc1-c1nc2ccc(F)c(C)c2[nH]1
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1ccc(cc1)C#N |r|
C[C@@H]1CCCN1CCc1ccc2ncccc2c1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(C)ccc2c1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)C1CC1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)C(C)(C)C |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1nccs1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)C1=NCCS1 |r,t:21|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1sc(C)nc1C |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cccnc1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1ccncc1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1ccc(Cl)nc1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1ccc(C)nc1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1ccc(C)nc1C |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cc(C#N)c(C)nc1C |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cc(C(N)=O)c(C)nc1C |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1c(O)ccnc1C(F)(F)F |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cnccn1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1csc(n1)-c1cc(Cl)nc(Cl)c1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1csc(n1)-c1ccccc1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1csc(n1)-c1ccc(OCC(F)(F)F)nc1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1ccc(s1)-c1ccc(C)s1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cnn(c1C)-c1ccc(Cl)c(Cl)c1 |r|
CCOC(=O)c1c(C)noc1-c1ccc2cc(CCN3CCC[C@H]3C)ccc2n1 |r|
CCOC(=O)c1cc(on1)-c1ccc2cc(CCN3CCC[C@H]3C)ccc2n1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cc[nH]n1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cn[nH]c1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cn[nH]c1C |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cnn(C)c1C |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1c(C)n[nH]c1C |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1ccoc1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1ccsc1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cccs1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cncnc1 |r|
COc1ncc(cn1)-c1ccc2cc(CCN3CCC[C@H]3C)ccc2n1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cc(C)nc(n1)-c1ccccc1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)N1CCC(C)CC1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1ccc(cc1)N1CCCCC1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1ccc(cc1)-n1ccc(=O)cc1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cnc(s1)-c1ccccc1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1sc(nc1C)-c1cccs1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1sc(nc1C)-c1cnccn1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1sc(nc1C)N1CCOCC1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1sc(nc1C)-c1ccccn1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1sc(nc1C)-c1cccnc1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1nnn(c1C)-c1ccc(F)cc1F |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1onc(c1C)-c1ccc(Cl)cc1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1c(C)onc1-c1ccc(Cl)cc1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1c(Cl)n(C)nc1-c1ccccc1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1c(C)onc1-c1ccccc1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1nc2ccccc2s1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1sc2nc3ccccc3n2c1C |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1sc2ncnn2c1C |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cn2CCSc2n1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1c(C)nc2ccccn12 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1ccc2nccnc2c1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1ccc2OCOCc2c1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1ccc(s1)C#N |r|
CCOC(=N)c1ccc(s1)-c1ccc2cc(CCN3CCC[C@H]3C)ccc2n1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1ccccn1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1sc(nc1C)-c1ccncc1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1csc(n1)-c1csc(C)n1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1csc(n1)-c1cc(C)on1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cnc2OCOc2c1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1ccn2ncnc2n1 |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cnn(c1C)-c1cc(cc(C)n1)C(F)(F)F |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cnn(c1C)-c1ccc(nn1)N(C)C |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1oc(C)nc1C |r|
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cc(Br)no1 |r|
CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)\C=C\c2cccnc2)CC1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC(C)C)CC2)cc1
CCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)OCC)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CCCC)CC2)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)S(=O)(=O)c2ccc(cc2)C#N)cc1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)CC)CC1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)\C=C\c2ccc(OC)cc2)CC1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)OC(C)C)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC3CC3)CC2)cc1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)c2ccc(F)cc2)CC1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2ccccc2)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)C(C)(C)O)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)C(C)C)cc1
CCCCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)OCC)cc1
CCCCCC(=O)c1ccc(OCCCN2CCCCC2)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)OCCCC)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)N2CCCC2)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(Cc3nccs3)CC2)cc1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)c2ccc(cc2)C(C)(C)C)CC1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)OC)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2occc2C)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CCC)CC2)cc1
CCCCCC(=O)c1ccc(OCCCN2CCNCC2)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)NCC)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)NC(C)C)cc1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)c2cccc(C)c2)CC1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2ccc(C)s2)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2cccnc2)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2c[nH]cn2)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2sccc2Cl)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)OCC(C)C)cc1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)CC(C)C)CC1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2ccco2)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2cccs2)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)S(=O)(=O)C(C)C)cc1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(C)=O)CC1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)CC)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2ccncc2)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)C2CCC2)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2cnco2)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)Cc2ccccc2)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)CCC)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)CSCC)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2cnccn2)cc1
[#6]-[#6]-[#8]-[#6](=O)-[#7]-1-[#6]-[#6]-[#7](-[#6]-[#6]-[#6]-[#8]-c2ccc(cc2)-[#6](=O)\[#6]=[#6](\[#6])-[#6])-[#6]-[#6]-1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)c2ccc(SC)cc2)CC1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C(C)=C)CC1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)Cc2ccccc2)CC1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2ccccn2)cc1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)c2ccc(OC)cc2)CC1
CCCCCC(=O)c1ccc(OCCCC2CCNCC2)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)c2cccn2C)cc1
CCCCCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)OCC)cc1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)c2cccc(F)c2F)CC1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)S(C)(=O)=O)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)C2CC2)cc1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CCCCC2)CC1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)N2CCOCC2)cc1
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
CN[C@H](C(C)C)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
O=C(C1CC1)c1ccc(OCCCN2CCN(CC2)C(=O)[C@H]2CCCN2)cc1
N[C@H](CCc1ccccc1)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
N[C@H](Cc1ccc(F)cc1)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
N[C@H](Cc1ccsc1)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
N[C@H](C1Cc2ccccc2C1)C(O)=O |r|
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)[C@@H](Cc2ccncc2)NC(=O)OC(C)(C)C)cc1
O=C(C[C@H]1CCCN1)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
CC[C@@H](N)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
N[C@@H](C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1)c1ccccc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)[C@H](N)CC(C)C)cc1
N[C@H](Cc1c[nH]cn1)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
C[C@H](N)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
N[C@H](Cc1ccc(cc1)-c1ccccc1)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
O=C(C1CC1)c1ccc(OCCCN2CCN(CC2)[C@H]2CC(=O)N2)cc1
N[C@H](Cc1cc2ccccc2s1)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
N[C@H](Cc1cccc2ccccc12)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
CC(C)N[C@H](C)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
O=C(C1CC1)c1ccc(OCCCN2CCN(CC2)[C@@H]2CC(=O)N2)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)[C@@H](N)Cc2ccncc2)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)[C@H](N)CO)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)[C@@H](N)CC(C)C)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)[C@H](NC(=O)OC(C)(C)C)C(C)C)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)[C@@H](CO)NC(=O)OC(C)(C)C)cc1
N[C@H](CC#N)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)cc1
CC(C)(C)C[C@@H](N)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
CCC[C@@H](N)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)[C@H](Cc2ccncc2)NC(=O)OC(C)(C)C)cc1
N[C@H](Cc1ccc(O)cc1)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
C[C@@H](CN)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
C[C@H](CN)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
O=C(C1CC1)c1ccc(OCCCN2CCN(CC2)C(=O)[C@@H]2CCN2)cc1
CC[C@H](N)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
CN[C@H](Cc1ccccc1)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
CNCC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)cc1
C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)[C@@H](C)NC(=O)OC(C)(C)C)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)[C@@H](N)C(C)C)cc1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)[C@H](N)C(C)C)cc1
N[C@H](Cc1nccs1)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
O=C(C1CC1)c1ccc(OCCCN2CCN(CC2)C(=O)[C@H]2CCN2)cc1
N[C@H](CC1CCCCC1)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)[C@@H](C)N)cc1
NCCC(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
CC(C)(C)[C@@H](N)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
CC(C)(C)OC[C@@H](N)C(=O)N1CCN(CCCOc2ccc(cc2)C(=O)C2CC2)CC1
CCCCCC(=O)c1ccc(OCCCN2CCN(CC2)C(=O)[C@H](N)Cc2ccncc2)cc1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)-c2cccs2)CC1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)-c2ccncc2)CC1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)-c2ccc(OC)cc2)CC1
N#Cc1ccc(cc1)-c1ccc(OCCCN2CCCC2)cc1
N#Cc1ccc(cc1)-c1ccc(OCCCN2CCOCC2)cc1
O[C@@H]1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C#N)C1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C#N)CC1
N#Cc1ccc(cc1)-c1ccc(OCCCN2CCNCC2)cc1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)-c2c[nH]cn2)CC1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)-c2ccsc2)CC1
CC1CCCCN1CCCOc1ccc(cc1)-c1ccc(cc1)C#N
N#Cc1ccc(cc1)-c1ccc(OCCCN2CCCNCC2)cc1
CN[C@@H]1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C#N)C1
CC1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C#N)CC1
CC1CCCN(CCCOc2ccc(cc2)-c2ccc(cc2)C#N)C1
N[C@@H]1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C#N)C1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)-c2ccc(cc2C)C#N)CC1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)-c2ccccc2[N+]([O-])=O)CC1
C[C@@]1(O)CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C#N)C1
CC1CCCC(C)N1CCCOc1ccc(cc1)-c1ccc(cc1)C#N
CCOC(=O)N1CCN(CCCOc2ccc(cc2)-c2ccc(OC(F)(F)F)cc2)CC1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)-c2cc[nH]c2)CC1
OC1CCCN(CCCOc2ccc(cc2)-c2ccc(cc2)C#N)C1
N#Cc1ccc(cc1)-c1ccc(OCCCN2CC3CNCC3C2)cc1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)-c2cccc(c2)C#N)CC1
NC1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C#N)CC1
C[C@@H]1CC[C@@H](C)N1CCCOc1ccc(cc1)-c1ccc(cc1)C#N
OC1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C#N)CC1
O[C@H]1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C#N)C1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)[N+]([O-])=O)CC1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)-c2ccc(Br)cc2)CC1
CCOC(=O)N1CCN(CCCOc2ccc(cc2)-c2ccc(Cl)cc2)CC1
CN(C)CCCN(C(C)=O)c1c2CCCCCc2nc2ccccc12
[H][C@@]12CN(CCCNc3c4CCCCCc4nc4ccccc34)C[C@]1([H])[C@H]2NC(=O)OC(C)(C)C
CC(C)(C)OC(=O)N1CCCN(CC1)c1c2CCCCCc2nc2ccccc12
CN(C)CCC#Cc1c2CCCCCc2nc2ccccc12
C(CN1CCCCCC1)C#Cc1c2CCCCCc2nc2ccccc12
C(CN1CCOCC1)C#Cc1c2CCCCCc2nc2ccccc12
C(CN1CCCCC1)\C=C/c1c2CCCCCc2nc2ccccc12
OC[C@@H]1CCN(CCC#Cc2c3CCCCCc3nc3ccccc23)C1
C(CNc1c2CCCCCc2nc2ccccc12)Cn1ccnc1
OC[C@H]1CCN(CCC#Cc2c3CCCCCc3nc3ccccc23)C1
CN(C)CCNc1c2CCCCCc2nc2ccccc12
C1CCc2nc3ccccc3c(N3CCCNCC3)c2CC1
CN(C)CCCNc1c2CCCCc2nc2CCCCCc12
C(CN1CCCC1)C#Cc1c2CCCCCc2nc2ccccc12
[H][C@@]12CN(CCCNc3c4CCCCCc4nc4ccccc34)C[C@]1([H])[C@H]2N
CN1CCN(CCC#Cc2c3CCCCCc3nc3ccccc23)CC1
CN1CCN(CCCNc2c3CCCCCc3nc3ccccc23)CC1
CC(C)(C)OC(=O)N1CCN(CC1)c1c2CCCCCc2nc2ccccc12
C(CN1CCCCC1)C#Cc1c2CCCCCCc2nc2ccccc12
C(CNc1c2CCCCCc2nc2ccccc12)CN1CCOCC1
CN(C)CCCNc1c2CSCCc2nc2ccccc12
CN(C)CCCCNc1c2CCCCCc2nc2ccccc12
CN1CCN(CC1)C(c1nnnn1Cc1ccccc1)c1ccccc1
Fc1ccc(cc1)C(N1CCCCC1)c1nnnn1Cc1ccccc1
Fc1ccc(cc1)C(N1CCOCC1)c1nnnn1Cc1ccccc1
CN(C)CCN(C)C(c1nnnn1Cc1ccccc1)c1ccc(F)cc1
Fc1ccc(cc1)C(N1CCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
Fc1ccc(cc1)C(N1CCN(CC1)C1CCCC1)c1nnnn1Cc1ccccc1
Fc1ccc(cc1)C(N1CCN(CC1)C1CCCCC1)c1nnnn1Cc1ccccc1
CN1CCCN(CC1)C(c1nnnn1Cc1ccccc1)c1ccc(F)cc1
CCN1CCCN(CC1)C(c1nnnn1Cc1ccccc1)c1ccc(F)cc1
Fc1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
Fc1ccc(cc1)C(N1CCCN(CC1)C1CCCC1)c1nnnn1Cc1ccccc1
C[C@@H]1CN(CCN1C1CCC1)C(c1nnnn1Cc1ccccc1)c1ccc(F)cc1 |r|
C[C@H]1CN(C[C@@H](C)N1C1CCC1)C(c1nnnn1Cc1ccccc1)c1ccc(F)cc1 |r|
C[C@@H]1CN(CCN1)C(c1nnnn1Cc1ccccc1)c1ccc(F)cc1 |r|
Fc1ccc(cc1)C(N1C[C@@H]2C[C@H]1CN2C1CCC1)c1nnnn1Cc1ccccc1 |r|
Fc1ccc(cc1)C(N1C[C@@H]2CC[C@H](C1)N2C1CCC1)c1nnnn1Cc1ccccc1 |r,THB:16:15:8.9.14:11.12|
Fc1ccc(cc1)C(N1CCN(CC#C)CC1)c1nnnn1Cc1ccccc1
Fc1ccc(cc1)C(N1CCN(CC2CCCO2)CC1)c1nnnn1Cc1ccccc1
Fc1ccc(cc1)C(N1CCn2cnnc2C1)c1nnnn1Cc1ccccc1
CN(C)C1CCN(CC1)C(c1nnnn1Cc1ccccc1)c1ccc(F)cc1
Fc1ccc(cc1)C(N1CCC(CC1)N1CCCC1)c1nnnn1Cc1ccccc1
CN(C)C1CCCN(C1)C(c1nnnn1Cc1ccccc1)c1ccc(F)cc1
CN1CCC(CC1)N1CCN(CC1)C(c1nnnn1Cc1ccccc1)c1ccc(F)cc1
CNC(=O)c1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
CS(=O)(=O)c1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
CN1CCN(Cc2ccc(cc2)C(N2CCCN(CC2)C2CCC2)c2nnnn2Cc2ccccc2)CC1
C(c1ccccc1)n1nnnc1C(N1CCCN(CC1)C1CCC1)c1ccc(cc1)-n1cncn1
C(c1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1)n1cncn1
C(c1ccccc1)n1nnnc1C(N1CCCN(CC1)C1CCC1)c1ccc2occc2c1
Clc1ccccc1C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
FC(F)Oc1ccccc1C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
Clc1cccc(c1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
FC(F)Oc1cccc(c1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
C(c1ccccc1)n1nnnc1C(N1CCCN(CC1)C1CCC1)c1ccccc1
CC(C)c1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
FC(F)(F)c1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
CCOc1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
FC(F)Oc1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
FC(F)(F)Oc1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
Clc1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
Brc1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
NC(=O)c1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
O=C(Nc1ccccc1)c1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
O=C1CCCN1c1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
CN(C)S(=O)(=O)c1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
C(c1ccccc1)n1nnnc1C(N1CCCN(CC1)C1CCC1)c1ccc(cc1)N1CCOCC1
C(N1CCOCC1)c1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
CN1CCN(CC1)c1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
C(c1ccccc1)n1nnnc1C(N1CCCN(CC1)C1CCC1)c1ccc(cc1)-n1cccc1
C(c1ccccc1)n1nnnc1C(N1CCCN(CC1)C1CCC1)c1ccc(cc1)-n1cccn1
Cc1nccn1-c1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
Cc1nonc1-c1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
Cc1nc(cs1)-c1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
C(c1ccccc1)n1nnnc1C(N1CCCN(CC1)C1CCC1)c1ccc(cc1)-c1csnn1
C(c1ccc(cc1)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1)n1cccn1
C(c1ccccc1)n1nnnc1C(N1CCCN(CC1)C1CCC1)c1ccc(cc1)-c1ccccn1
C(c1ccccc1)n1nnnc1C(N1CCCN(CC1)C1CCC1)c1ccc(Oc2ccccn2)cc1
C(c1ccccc1)n1nnnc1C(N1CCCN(CC1)C1CCC1)c1ccc(Oc2ncccn2)cc1
C(c1ccccc1)n1nnnc1C(N1CCCN(CC1)C1CCC1)c1ccc2OCCc2c1
C(c1ccccc1)n1nnnc1C(N1CCCN(CC1)C1CCC1)c1ccc2[nH]ccc2c1
Cn1ccc2cc(ccc12)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
C(c1ccccc1)n1nnnc1C(N1CCCN(CC1)C1CCC1)c1ccc2cc[nH]c2c1
Cn1nnc2cc(ccc12)C(N1CCCN(CC1)C1CCC1)c1nnnn1Cc1ccccc1
C(c1ccccc1)n1nnnc1C(N1CCCN(CC1)C1CCC1)c1ccc2ncccc2c1
O=C(C1CCN(Cc2ccnc3ccccc23)CC1)N1CCC(CC1)n1c2ccccc2[nH]c1=O
O=C(C1CCN(Cc2ccoc2)CC1)N1CCC(CC1)n1c2ccccc2[nH]c1=O
O=C(C1CCN(Cc2ccsc2)CC1)N1CCC(CC1)n1c2ccccc2[nH]c1=O
CC(N1CCC(CC1)C(=O)N1CCC(CC1)n1c2ccccc2[nH]c1=O)c1ccncc1
O=C(C1CCN(CCc2ccncc2)CC1)N1CCC(CC1)n1c2ccccc2[nH]c1=O
Clc1cnccc1CN1CCC(CC1)C(=O)N1CCC(CC1)n1c2ccccc2[nH]c1=O
ON1C=CC(CN2CCC(CC2)C(=O)N2CCC(CC2)n2c3ccccc3[nH]c2=O)C=C1 |c:2,34|
O=C(C1CCN(Cc2cccnc2)CC1)N1CCC(CC1)n1c2ccccc2[nH]c1=O
COc1ccc(Cn2c3ccccc3n(C3CCN(CC3)C(=O)C3CCN(Cc4ccncc4)CC3)c2=O)cc1
COc1cccc(Cn2c3ccccc3n(C3CCN(CC3)C(=O)C3CCN(Cc4ccncc4)CC3)c2=O)c1
Clc1ccc(Cn2c3ccccc3n(C3CCN(CC3)C(=O)C3CCN(Cc4ccncc4)CC3)c2=O)cc1
Clc1cccc(Cn2c3ccccc3n(C3CCN(CC3)C(=O)C3CCN(Cc4ccncc4)CC3)c2=O)c1
Clc1ccccc1Cn1c2ccccc2n(C2CCN(CC2)C(=O)C2CCN(Cc3ccncc3)CC2)c1=O
O=C(C1CCN(Cc2ccncc2)CC1)N1CCC(CC1)n1c2ccccc2n(Cc2ccccc2)c1=O
CN(C)CCCn1c2ccccc2n(C2CCN(CC2)C(=O)C2CCN(Cc3ccncc3)CC2)c1=O
O=C(C1CCN(Cc2ccncc2)CC1)N1CCC(CC1)n1c2ccccc2n(CCN2CCOCC2)c1=O
O=C(C1CCN(Cc2ccncc2)CC1)N1CCC(CC1)n1c2ccccc2n(CCN2CCCCC2)c1=O
CN(C)CCn1c2ccccc2n(C2CCN(CC2)C(=O)C2CCN(Cc3ccncc3)CC2)c1=O
CCOCCCn1c2ccccc2n(C2CCN(CC2)C(=O)C2CCN(Cc3ccncc3)CC2)c1=O
O=C(C1CCN(Cc2ccncc2)CC1)N1CCC(CC1)n1c2ccccc2n(CCOc2ccccc2)c1=O
CC(C)OCCn1c2ccccc2n(C2CCN(CC2)C(=O)C2CCN(Cc3ccncc3)CC2)c1=O
CCOCCn1c2ccccc2n(C2CCN(CC2)C(=O)C2CCN(Cc3ccncc3)CC2)c1=O
COCCn1c2ccccc2n(C2CCN(CC2)C(=O)C2CCN(Cc3ccncc3)CC2)c1=O
OCCn1c2ccccc2n(C2CCN(CC2)C(=O)C2CCN(Cc3ccncc3)CC2)c1=O
CC(C)Cn1c2ccccc2n(C2CCN(CC2)C(=O)C2CCN(Cc3ccncc3)CC2)c1=O
Cn1c2ccccc2n(C2CCN(CC2)C(=O)C2CCN(Cc3ccncc3)CC2)c1=O
O=C(N1CCC(CC1)n1c2ccccc2[nH]c1=O)N1CCN(Cc2ccncc2)CC1
O=C(CC1CCN(Cc2ccncc2)CC1)N1CCC(CC1)n1c2ccccc2[nH]c1=O
O=c1[nH]c2ccccc2n1C1CCN(CC2CCN(Cc3ccncc3)CC2)CC1
O=C(C1CCN(Cc2ccncc2)CC1)N1CCC2(CC1)N(CNC2=O)c1ccccc1
O=C(C1CCN(Cc2ccncc2)CC1)N1CCC(CC1)n1c2ccccc2[nH]c1=O
O=C(C1CCN(Cc2ccncc2)CC1)N1CCC(CC1)C(=O)c1ccccc1
OC1(Cc2ccccc2)CCN(CC1)C(=O)C1CCN(Cc2ccncc2)CC1
O=C(C1CCN(Cc2ccncc2)CC1)N1CCC(Cc2ccccc2)CC1
CN1CCN(CC1)C(=O)C1CCN(Cc2ccncc2)CC1
O=C(C1CCN(Cc2ccncc2)CC1)N1CCN(CC1)C1CCCCC1
O=C(C1CCN(Cc2ccncc2)CC1)N1CCN(CC1)c1ccccc1
O=C(C1CCN(Cc2ccncc2)CC1)N1CCN(Cc2ccccc2)CC1
Clc1cccc(CN2CCN(CC2)C(=O)C2CCN(Cc3ccncc3)CC2)c1
COCCCNC(=O)c1cccc(CN2CCN(CC2)C(=O)C2CCN(Cc3ccncc3)CC2)c1
O=C(NCCc1ccccc1)c1cccc(CN2CCN(CC2)C(=O)C2CCN(Cc3ccncc3)CC2)c1
CC(C)(C)CCC#C[C@@H]1C[C@H]1c1c[nH]cn1
O=C(N1CCCC1)c1ccc(cc1)-c1ccc(OCCCN2CCOCC2)cc1
CC1CCN(CC1)C(=O)c1ccc(cc1)-c1ccc(OCCCN2CC[C@H](O)C2)cc1
CC(C)NCCCOc1ccc(cc1)-c1ccc(cc1)C(=O)N1CCOCC1
CCN(CC)C(=O)c1ccc(cc1)-c1ccc(OCCCN2CC[C@@H](C2)N(C)C)cc1
CC(C)NCCCOc1ccc(cc1)-c1ccc(cc1)C(=O)N1CCCC1C
C[C@H]1CC[C@H](C)N1CCCOc1ccc(cc1)-c1ccc(cc1)C(=O)N1CCCC1C
C[C@H]1CC[C@H](C)N1C(=O)c1ccc(cc1)-c1ccc(OCCCN2CC[C@@H](C2)N(C)C)cc1
C[C@H]1CC[C@H](C)N1C(=O)c1ccc(cc1)-c1ccc(OCCCN2CC[C@H](O)C2)cc1
CCN(CC)C(=O)c1ccc(cc1)-c1ccc(OCCCN2CC[C@H](O)C2)cc1
CCN(CC)CCCOc1ccc(cc1)-c1ccc(cc1)C(=O)N1CCCC1C
CC1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C(=O)N2CCOCC2)CC1
CC(C)NCCCOc1ccc(cc1)-c1ccc(cc1)C(=O)N1CCC(C)CC1
CC(C)NCCCOc1ccc(cc1)-c1ccc(cc1)C(=O)N1[C@@H](C)CC[C@@H]1C
CCN(CC)CCCOc1ccc(cc1)-c1ccc(cc1)C(=O)N1[C@@H](C)CC[C@@H]1C
CC1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C(=O)N2CCC(C)CC2)CC1
CC1CCCN1C(=O)c1ccc(cc1)-c1ccc(OCCCN2CCC(C)CC2)cc1
CCN(CC)C(=O)c1ccc(cc1)-c1ccc(OCCCN2CCOCC2)cc1
C[C@H]1CC[C@H](C)N1CCCOc1ccc(cc1)-c1ccc(cc1)C(=O)N1CCOCC1
CCN(CC)CCCOc1ccc(cc1)-c1ccc(cc1)C(=O)N1CCOCC1
CCN(CC)CCCOc1ccc(cc1)-c1ccc(cc1)C(=O)NC(C)C
C[C@H]1CC[C@H](C)N1C(=O)c1ccc(cc1)-c1ccc(OCCCN2CCOCC2)cc1
O=C(N1CCCC1)c1ccc(cc1)-c1ccc(OCCCN2CCCC2)cc1
CC1CCCN1C(=O)c1ccc(cc1)-c1ccc(OCCCN2CC[C@H](O)C2)cc1
CC(C)NC(=O)c1ccc(cc1)-c1ccc(OCCCN2CCC(C)CC2)cc1
CCN(CC)C(=O)c1ccc(cc1)-c1ccc(OCCCN2CCC(C)CC2)cc1
CCN(CC)C(=O)c1ccc(cc1)-c1ccc(OCCCN2[C@@H](C)CC[C@@H]2C)cc1
C[C@H]1CC[C@H](C)N1C(=O)c1ccc(cc1)-c1ccc(OCCCN2CCC(C)CC2)cc1
O[C@H]1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C(=O)N2CCOCC2)C1
C[C@H]1CC[C@H](C)N1CCCOc1ccc(cc1)-c1ccc(cc1)C(=O)N1CCC(C)CC1
O[C@H]1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C(=O)N2CCCC2)C1
CC1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C(=O)N2CCCC2)CC1
CC1CCCN1C(=O)c1ccc(cc1)-c1ccc(OCCCN2CCOCC2)cc1
C[C@H]1CC[C@H](C)N1CCCOc1ccc(cc1)-c1ccc(cc1)C(=O)N1CCCC1
CC(C)N(C)C(=O)c1ccc(cc1)-c1ccc(OCCCN2CC[C@H](O)C2)cc1
C[C@H]1CC[C@H](C)N1CCCOc1ccc(cc1)-c1ccc(cc1)C(=O)N1[C@@H](C)CC[C@@H]1C
O=C(N1CCOCC1)c1ccc(cc1)-c1ccc(OCCCN2CCOCC2)cc1
CCN(CC)CCCOc1ccc(cc1)-c1ccc(cc1)C(=O)N1CCC(C)CC1
CCN(CC)C(=O)c1ccc(cc1)-c1ccc(OCCCNC(C)C)cc1
CC(C)NC(=O)c1ccc(cc1)-c1ccc(OCCCN2[C@@H](C)CC[C@@H]2C)cc1
CCN(CC)CCCOc1ccc(cc1)-c1ccc(cc1)C(=O)N1CCCC1
CC1CCN(CC1)C(=O)c1ccc(cc1)-c1ccc(OCCCN2CCOCC2)cc1
CN(C)[C@@H]1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C(=O)N2CCOCC2)C1
CC(C)NC(=O)c1ccc(cc1)-c1ccc(OCCCN2CCOCC2)cc1
CN(C)[C@@H]1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C(=O)N2CCCC2)C1
CC1CCN(CC1)C(=O)c1ccc(cc1)-c1ccc(OCCCN2CC[C@H](C2)N(C)C)cc1
CC1CCCN1C(=O)c1ccc(cc1)-c1ccc(OCCCN2CC[C@@H](C2)N(C)C)cc1
CNCC(CSc1ccc(cc1)C(F)(F)F)c1cnc[nH]1
CNCC(CSc1ccc(cc1)C(C)(C)C)c1cnc[nH]1
FC(F)(F)c1ccc(SC[C@H](C2CCNCC2)c2cnc[nH]2)cc1 |r|
CC(C)(C)c1ccc(SCC(C2CCNCC2)c2cnc[nH]2)cc1
FC(F)(F)c1ccc(SCC(c2cnc[nH]2)c2ccccn2)cc1
CC(C)(C)c1ccc(SCC(c2cnc[nH]2)c2ccccn2)cc1
FC(F)(F)c1ccc(SCC(c2cnc[nH]2)c2cccnc2)cc1
CC(C)(C)c1ccc(SCC(c2cnc[nH]2)c2cccnc2)cc1
FC(F)(F)c1ccc(SCC(c2cnc[nH]2)c2ccncc2)cc1
CC(C)(C)c1ccc(SCC(c2cnc[nH]2)c2ccncc2)cc1
C(c1cnc[nH]1)c1ccccn1
C(c1cnc[nH]1)c1cccnc1
FC(F)(F)c1ccc(SC[C@@H](C2CCNCC2)c2cnc[nH]2)cc1 |r|
C[C@H]1Cc2c([nH]c3cc(Cl)c(F)cc23)[C@@]2(N1)C(=O)Nc1ccc(Cl)cc21 |r|
C(CCc1ncc(o1)-c1ccccc1)CN1CCCCC1
C(CCc1nc(no1)-c1cccnc1)CN1CCCCC1
C(CSc1nc(c(s1)-c1ccccc1)-c1ccccc1)CN1CCCCC1
CC(=O)c1sc(SCCCN2CCCCC2)nc1C
C(CSc1nc(c(o1)-c1ccccc1)-c1ccccc1)CN1CCCCC1
C(CSc1nnc(o1)-c1ccncc1)CN1CCCCC1
C(CSc1nc(-c2ccncc2)n(CCCN2CCCCC2)n1)CN1CCCCC1
C(COc1nc(c(s1)-c1ccccc1)-c1ccccc1)CN1CCCCC1
C(COc1nc2CCN(CCCN3CCCCC3)Cc2s1)CN1CCCCC1
CN(C)CCCOc1nc2CN(C)CCc2s1
CN(C)CCCOc1nc2CCCCc2s1
CN(C)CCCOc1nc2COCCc2s1
CN(C)CCCOc1nc2c(CCCC2=O)s1
CN1CCc2sc(OCCCN3CCCCC3)nc2C1
CCN1CCc2sc(OCCCN3CCCCC3)nc2C1
C(COc1nc2CN(Cc3ccccc3)CCc2s1)CN1CCCCC1
C(COc1nc2CN(CCCN3CCCCC3)CCc2s1)CN1CCCCC1
C(COc1nc2CCCCc2s1)CN1CCCCC1
C(COc1nc2COCCc2s1)CN1CCCCC1
Brc1nc(OCCCN2CCCCC2)sc1-c1ccccc1
Cc1nc(OCCCN2CCCCC2)sc1-c1ccccc1
CC(=O)c1nc(OCCCN2CCCCC2)sc1C
O=C1CCCc2sc(OCCCN3CCCCC3)nc12
CC(C)N1CCC(CC1)Oc1ccc2n3C[C@@H](C)N(CC4CC4)C(=O)c3cc2c1 |r|
CC(C)N1CCC(CC1)Oc1ccc2n(C(C)C)c(cc2c1)C(=O)N1CCC(F)(F)CC1
CC(C)N1CCC(CC1)Oc1cc2cc3C(=O)N(CC4CC4)C[C@H](C)n3c2cc1Br |r|
CC(C)N1CCC(CC1)Oc1cc2cc3C(=O)NC[C@H](C)n3c2cc1Br |r|
C[C@@H]1CCCN1CCCOc1ccc2n3CCNC(=O)c3cc2c1 |r|
CC(C)N1CCC(CC1)Oc1ccc2n3CCN(Cc4cccnc4)C(=O)c3cc2c1
CC(C)N1CCC(CC1)Oc1ccc2n3CCN(Cc4ccncc4)C(=O)c3cc2c1
CC(C)N1CCC(CC1)Oc1ccc2n3CCN(Cc4ccccc4F)C(=O)c3cc2c1
CC(C)N1CCC(CC1)Oc1ccc2n3CCN(Cc4ccccn4)C(=O)c3cc2c1
CC(C)N1CCC(CC1)Oc1ccc2n3C[C@H](C)NC(=O)c3cc2c1 |r|
CC(C)N1CCC(CC1)Oc1ccc2n3CCN(Cc4ccc(F)cc4)C(=O)c3cc2c1
CC(C)N1CCC(CC1)Oc1ccc2n3CCN(CC4CC4)C(=O)c3cc2c1
CC(C)N1CCC(CC1)Oc1ccc2n3C[C@@H](C)NC(=O)c3cc2c1 |r|
C[C@H]1CC[C@H](C)N1CCCOc1ccc2n3CCNC(=O)c3cc2c1 |r|
CC(C)N1CCC(CC1)Oc1ccc2n3CCN(Cc4cccc(F)c4)C(=O)c3cc2c1
CC(C)N1CCC(CC1)Oc1ccc2n3CCCNC(=O)c3cc2c1
CC(C)N1CCC(CC1)Oc1ccc2n3CCCN(CC4CC4)C(=O)c3cc2c1
O=C1NCCn2c1cc1cc(OCCCN3CCCCC3)ccc21
COCCN1CCn2c(cc3cc(OC4CCN(CC4)C(C)C)ccc23)C1=O
C[C@H]1CCCN1CCCOc1ccc2n3CCNC(=O)c3cc2c1 |r|
CC(C)N1CCC(CC1)Oc1ccc2n3CCNC(=O)c3cc2c1
CC(C)N1CCC(CC1)Oc1ccc2n3CCN(C(C)C)C(=O)c3cc2c1
CC(C)N1CCC(CC1)Oc1ccc2n3[C@H](C)CNC(=O)c3cc2c1 |r|
CC(C)N1CCC(CC1)Oc1ccc2n3CCN(C)C(=O)c3cc2c1
CC(C)N1CCC(CC1)Oc1ccc2n3CCN(CC(F)(F)F)C(=O)c3cc2c1
CC(C)N1CCC(CC1)Oc1ccc2n3[C@@H](C)CNC(=O)c3cc2c1 |r|
CC(C)N1CCC(CC1)Oc1ccc2n3CCN(CCO)C(=O)c3cc2c1
O=C1NCCn2c1cc1cc(OC3CCN(CC4CC4)CC3)ccc21
CC(C)N1CCC(CC1)Oc1ccc2[nH]c3c(CCNC3=O)c2c1
CCCCN1CCC(COC(=O)c2cc(Cl)c(NC)c3OCCOc23)CC1
CCCCN1CCC(COC(=O)c2cc(F)c(N)c3OCCOc23)CC1
CCCCN1CCC(COC(=O)c2ccc(N)c(OC)c2)CC1
CC1CC(O)(C#Cc2cccc3ccccc23)C(C)CN1C
C[C@@H]1C[C@@](O)(C#Cc2cccc3ccccc23)[C@@H](C)CN1C |r|
C[C@H]1C[C@](O)(C#Cc2cccc3ccccc23)[C@H](C)CN1C |r|
CC1CC(OC(C)=O)(C#Cc2cccc3ccccc23)C(C)CN1C
CC1CC(O)(\C=C\c2cccc3ccccc23)C(C)CN1C
CC1CC(O)(CCc2cccc3ccccc23)C(C)CN1C
C[C@@H]1C[C@@](O)(CCc2cccc3ccccc23)[C@@H](C)CN1C |r|
CC1CC(O)(C#Cc2ccc3ccccc3c2)C(C)CN1C
CC1CC(O)(CCc2ccc3ccccc3c2)C(C)CN1C
CC1CN2CCCC2CC1(O)C#Cc1cccc2ccccc12
CC1CN2CCCC2CC1(O)CCc1cccc2ccccc12
CC1CC(O)(C#Cc2cccc3ncccc23)C(C)CN1C
CC1CC(O)(C#Cc2cccc3cccnc23)C(C)CN1C
CNCc1cc(ccc1Oc1ccc(Cl)c(Cl)c1)C(=O)N1CCN(CC1)C1CC1
CC(C)N1CCN(CC1)C(=O)c1cccc2[nH]cc(CN3CCOCC3)c12
CC(C)N1CCN(CC1)C(=O)c1ccc2[nH]cc(CN3CCCCC3)c2c1
CC(C)N1CCN(CC1)C(=O)c1ccc2[nH]cc(CN3CCOCC3)c2c1
CC(C)N1CCN(CC1)C(=O)c1ccc2c(CN3CCCCC3)c[nH]c2c1
CC(C)N1CCN(CC1)C(=O)c1ccc2c(CN3CCOCC3)c[nH]c2c1
CC(C)N1CCN(CC1)C(=O)c1cccc2c(CN3CCCCC3)c[nH]c12
CC(C)N1CCN(CC1)C(=O)c1cccc2c(CN3CCOCC3)c[nH]c12
CC(C)N1CCN(CC1)C(=O)c1ccc2c(CN3CCCCC3)cn(c2c1)S(C)(=O)=O
CC(C)N1CCN(Cc2c[nH]c3cc(ccc23)C(=O)N2CCCCC2)CC1
O=C(N1CCOCC1)c1ccc2c(CN3CCN(CC3)C3CCC3)c[nH]c2c1
O=C(N1CCN(CC1)C1CC1)c1ccc2c(CN3CCOCC3)c[nH]c2c1
O=C(N1CCN(CC1)C1CCC1)c1ccc2c(CN3CCOCC3)c[nH]c2c1
CC(C)N1CCCN(CC1)C(=O)c1ccc2c(CN3CCOCC3)cn(C)c2c1
CC(C)N1CCN(CC1)C(=O)c1ccc2c(CN3CCOCC3)cn(C)c2c1
O=C(N1CCN(CC1)C1CCC1)c1cccc2c(CN3CCCCC3)c[nH]c12
O=C(N1CCN(CC1)C1CCC1)c1cccc2c(CN3CCOCC3)c[nH]c12
O=C(N1CCNCC1)c1cccc2c(CN3CCOCC3)c[nH]c12
O=C(N1CCCCC1)c1cccc2c(CN3CCN(CC3)C3CCC3)c[nH]c12
CC(C)N1CCN(CC1)C(=O)c1ccc2scc(CN3CCCCC3)c2c1
O=C(N1CCN(CC1)C1CCC1)c1ccc2scc(CN3CCCCC3)c2c1
CC(C)N1CCN(CC1)C(=O)c1ccc2scc(C(=O)N3CCCCC3)c2c1
O=C(N1CCCCC1)c1csc2ccc(cc12)C(=O)N1CCN(CC1)C1CCC1
COc1ccc(cc1)-c1ccc(CNC(=O)NC2CCN(Cc3ccc(C)cc3)CC2)cc1
COc1ccccc1-c1ccc(CNC(=O)NC2CCN(Cc3ccc(C)cc3)CC2)cc1
Cc1ccc(CN2CCC(CC2)NC(=O)NCc2ccc(cc2)-c2cccc(c2)C#N)cc1
Cc1ccc(CN2CCC(CC2)NC(=O)NCc2ccc(cc2)-c2ccccc2)cc1
Cc1ccc(CN2CCC(CC2)NC(=O)N(CC(=O)C(C)(C)O)Cc2ccc(cc2)-c2ccc(F)cc2)cc1
COc1ccc(cc1)-c1ccc(CN(CC(=O)C(C)(C)O)C(=O)NC2CCN(Cc3ccc(C)cc3)CC2)cc1
COc1ccccc1-c1ccc(CN(CC(=O)C(C)(C)O)C(=O)NC2CCN(Cc3ccc(C)cc3)CC2)cc1
Cc1ccc(CN2CCC(CC2)NC(=O)N(CC(=O)C(C)(C)O)Cc2ccc(cc2)-c2cccc(c2)C#N)cc1
Cc1ccc(CN2CCC(CC2)NC(=O)N(CC(=O)C(C)(C)O)Cc2ccc(cc2)-c2ccccc2)cc1
COc1ccc(cc1)-c1ccc(CN(CCC2CCN(Cc3ccc(C)cc3)CC2)C(=O)NC(C)C)cc1
COc1ccccc1-c1ccc(CN(CCC2CCN(Cc3ccc(C)cc3)CC2)C(=O)NC(C)C)cc1
CC(C)NC(=O)N(CCC1CCN(Cc2ccc(C)cc2)CC1)Cc1ccc(cc1)-c1cccc(c1)C#N
CC(C)NC(=O)N(CCC1CCN(Cc2ccc(C)cc2)CC1)Cc1ccc(cc1)-c1ccccc1
CC(=O)OCC(C)(C)NC(=O)N(CCC1CCN(Cc2ccc(C)cc2)CC1)Cc1ccc(cc1)-c1ccc(F)cc1
COc1ccc(cc1)-c1ccc(CN(CCC2CCN(Cc3ccc(C)cc3)CC2)C(=O)NC(C)(C)COC(C)=O)cc1
COc1ccccc1-c1ccc(CN(CCC2CCN(Cc3ccc(C)cc3)CC2)C(=O)NC(C)(C)COC(C)=O)cc1
CC(=O)OCC(C)(C)NC(=O)N(CCC1CCN(Cc2ccc(C)cc2)CC1)Cc1ccc(cc1)-c1cccc(c1)C#N
CC(=O)OCC(C)(C)NC(=O)N(CCC1CCN(Cc2ccc(C)cc2)CC1)Cc1ccc(cc1)-c1ccccc1
CCC(COC(C)=O)(COC(C)=O)NC(=O)N(CCC1CCN(Cc2ccc(C)cc2)CC1)Cc1ccc(cc1)-c1ccc(F)cc1
CCC(COC(C)=O)(COC(C)=O)NC(=O)N(CCC1CCN(Cc2ccc(C)cc2)CC1)Cc1ccc(cc1)-c1ccc(OC)cc1
CCC(COC(C)=O)(COC(C)=O)NC(=O)N(CCC1CCN(Cc2ccc(C)cc2)CC1)Cc1ccc(cc1)-c1ccccc1OC
CCC(COC(C)=O)(COC(C)=O)NC(=O)N(CCC1CCN(Cc2ccc(C)cc2)CC1)Cc1ccc(cc1)-c1cccc(c1)C#N
CCC(COC(C)=O)(COC(C)=O)NC(=O)N(CCC1CCN(Cc2ccc(C)cc2)CC1)Cc1ccc(cc1)-c1ccccc1
Cc1ccc(CN2CCC(CCN(Cc3ccc(cc3)-c3ccc(F)cc3)C(=O)NC(C)(C)CO)CC2)cc1
COc1ccc(cc1)-c1ccc(CN(CCC2CCN(Cc3ccc(C)cc3)CC2)C(=O)NC(C)(C)CO)cc1
COc1ccccc1-c1ccc(CN(CCC2CCN(Cc3ccc(C)cc3)CC2)C(=O)NC(C)(C)CO)cc1
Cc1ccc(CN2CCC(CCN(Cc3ccc(cc3)-c3cccc(c3)C#N)C(=O)NC(C)(C)CO)CC2)cc1
CCC(CO)(CO)NC(=O)N(CCC1CCN(Cc2ccc(C)cc2)CC1)Cc1ccc(cc1)-c1ccc(F)cc1
CCC(CO)(CO)NC(=O)N(CCC1CCN(Cc2ccc(C)cc2)CC1)Cc1ccc(cc1)-c1ccc(OC)cc1
CCC(CO)(CO)NC(=O)N(CCC1CCN(Cc2ccc(C)cc2)CC1)Cc1ccc(cc1)-c1ccccc1OC
CCC(CO)(CO)NC(=O)N(CCC1CCN(Cc2ccc(C)cc2)CC1)Cc1ccc(cc1)-c1cccc(c1)C#N
CNCC[C@@H](c1cccs1)Oc2cccc3c2cccc3
CNCCC(Oc1cccc2cc(OCCN3CCCC3)ccc12)c1ccccc1
CNCCC(c1ccccc1)c1ccc(O)c2ccc(OCCN3CCCC3)cc12
CNCCN(c1ccccc1)c1ccc(OCCN2CCCC2)cc1
CNCCCN(c1ccccc1)c1ccc(OCCN2CCCC2)cc1
CNCCC(c1ccccc1)c1ccc(OCCN2CCCC2)cc1
CNCCCC(c1ccccc1)c1ccc(OCCN2CCCC2)cc1
CNCCCN1c2ccccc2CCc3c1cccc3
O=C(NC1CCCC1)Nc1nnc(s1)N1CCC(CC1)N1CCCCC1
C1CCN(CC1)C1CCN(CC1)c1nnc(s1)-c1ccccc1
COc1cccc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
N#Cc1cccc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Fc1cccc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Clc1cccc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Cc1cccc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
CC(=O)c1cccc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Clc1cc(Cl)cc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
COc1cc(OC)cc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
COc1cc(Cl)cc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
COc1cc(cc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1)C#N
COc1cc(F)cc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Fc1cc(F)cc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
N#Cc1cc(cc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1)C#N
C1CCN(CC1)C1CCN(CC1)c1nnc(s1)-c1ccccn1
COc1cccc(n1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Cc1cccc(n1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
C1CCN(CC1)C1CCN(CC1)c1nnc(s1)-c1ncccn1
C1CCN(CC1)C1CCN(CC1)c1nnc(s1)-c1cn[nH]c1
COc1ncc(s1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
COc1ccc(cc1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
CCN1CCN(CC1)c1nnc(s1)-c1ccc(OC)cc1
COc1ccc(cc1)-c1nnc(s1)N1CCN(CC1)C1CCCC1
COc1ccc(cc1)-c1nnc(s1)N1CCN2CCCC2C1
COc1ccc(cc1)-c1nnc(s1)N1CCC(CC1)N1CCCC1
COc1ccccc1-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Fc1ccccc1-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Clc1ccccc1-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Cc1ccccc1-c1nnc(s1)N1CCC(CC1)N1CCCCC1
CC(=O)c1ccccc1-c1nnc(s1)N1CCC(CC1)N1CCCCC1
N#Cc1ccc(cc1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Fc1ccc(cc1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Clc1ccc(cc1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Cc1ccc(cc1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
CC(=O)c1ccc(cc1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
C=CCCCNC(=O)OCCCc1cnc[nH]1
O=C(NCCC1CC1)OCCCc1cnc[nH]1
CC(C)=CCC\C(C)=C\CNC(=O)OCCCc1cnc[nH]1 |(49.85,-16.23,;48.52,-15.46,;48.51,-13.92,;47.18,-16.23,;45.85,-15.46,;44.52,-16.24,;43.19,-15.46,;43.18,-13.94,;41.85,-16.23,;40.52,-15.46,;39.19,-16.23,;37.86,-15.45,;37.87,-13.91,;36.53,-16.22,;35.2,-15.44,;33.87,-16.21,;32.54,-15.44,;31.21,-16.21,;31.05,-17.74,;29.55,-18.06,;28.78,-16.73,;29.8,-15.59,)|
CCC\C=C\CNC(=O)OCCCc1cnc[nH]1
O=C(NCCC1CCCCC1)OCCCc1cnc[nH]1
CC\C=C\CCNC(=O)OCCCc1cnc[nH]1
O=C(NCCC1=CCCCC1)OCCCc1cnc[nH]1 |t:5|
CC\C=C\CNC(=O)OCCCc1cnc[nH]1
CC\C=C/CNC(=O)OCCCc1cnc[nH]1
O=C(NCCCCC1CCCCC1)OCCCc1cnc[nH]1
O=C(NCCCC1CCCCC1)OCCCc1cnc[nH]1
CC=CCNC(=O)OCCCc1cnc[nH]1 |w:1.0|
C=CCCNC(=O)OCCCc1cnc[nH]1
CC(C)N1CCN(CC1)C(=O)c1cc(CN2CCOCC2)cn1C
CC(C)N1CCN(CC1)C(=O)c1cc(CN2CCCCC2)cn1C
COCCNCc1ccc(s1)C(=O)N1CCN(CC1)C(C)C
CC(C)N1CCN(CC1)C(=O)c1ccc(CN2CCOCC2)s1
CC(C)N1CCN(CC1)C(=O)c1ccc(CN2CCCCC2)s1
COCCNCc1ccc(o1)C(=O)N1CCN(CC1)C(C)C
CC(C)N1CCN(CC1)C(=O)c1ccc(CN2CCOCC2)o1
CC(C)N1CCN(CC1)C(=O)c1ccc(CN2CCCCC2)o1
CC(C)N1CCN(CC1)C(=O)c1csc(CN2CCOCC2)c1
CC(C)N1CCN(CC1)C(=O)c1csc(CN2CCCCC2)c1
COCCNCc1nc(cs1)C(=O)N1CCN(CC1)C(C)C
CC(C)N1CCN(CC1)C(=O)c1csc(CN2CCOCC2)n1
CC(C)N1CCN(CC1)C(=O)c1csc(CN2CCCCC2)n1
COCCNCc1nc(co1)C(=O)N1CCN(CC1)C(C)C
CC(C)N1CCN(CC1)C(=O)c1coc(CN2CCOCC2)n1
CC(C)N1CCN(CC1)C(=O)c1coc(CN2CCCCC2)n1
CC(C)N1CCN(CC1)C(=O)c1ccc(CN2CCCCC2)cn1
CC(C)N1CCN(CC1)C(=S)c1ccc(CN2CCCCC2)nc1
CC(C)N1CCN(CC1)C(=O)c1cnc(CN2CCOCC2)cn1
CC(C)N1CCN(CC1)C(=O)c1cnc(CN2CCCCC2)cn1
CC(C)N1CCN(CC1)C(=O)c1ccc(CN2CCOCC2)nc1
CC(C)N1CCN(CC1)C(=O)c1ccc(CN2CCCCC2)nc1
COCCNCc1cc(OCCCN2CCCCC2)no1
C(COc1cc(CN2CCOCC2)on1)CN1CCCCC1
C(COc1cc(CN2CCCCC2)on1)CN1CCCCC1
C(COc1ccc(CN2CCCCC2)cn1)CN1CCCCC1
C(COc1ccc(CN2CCOCC2)nc1)CN1CCCCC1
C(COc1ccc(CN2CCCCC2)nc1)CN1CCCCC1
CNC(=O)c1cnc(Oc2ccc3CCN(CCc3c2)C2CCC2)cn1
Clc1ccc(cc1)C(=O)CCC(=O)N1CCN(CC1)C1CCCC1
CN(C)[C@H]1CC[C@H](CC1)c1ccc(OCCCN2CCCCC2)cc1 |r,wU:6.9,3.2,(26.01,2.94,;25.25,4.28,;26.03,5.61,;23.71,4.3,;22.92,2.97,;21.39,2.98,;20.63,4.32,;21.4,5.65,;22.95,5.64,;19.09,4.34,;18.31,3.01,;16.77,3.02,;16.01,4.36,;14.47,4.36,;13.7,3.03,;12.16,3.03,;11.39,4.37,;9.85,4.37,;9.08,3.04,;7.54,3.04,;6.77,4.37,;7.54,5.7,;9.08,5.7,;16.78,5.69,;18.32,5.68,)|
CN([C@H]1CC[C@@H](CC1)c1ccc(OCCCN2CCCCC2)cc1)S(=O)(=O)c1ccccc1 |r,wU:2.1,wD:5.8,(34.78,-44.7,;34,-46.03,;32.46,-46.02,;31.67,-47.34,;30.14,-47.33,;29.38,-45.99,;30.15,-44.66,;31.7,-44.68,;27.84,-45.98,;27.06,-47.3,;25.52,-47.3,;24.76,-45.96,;23.22,-45.95,;22.45,-47.29,;20.91,-47.28,;20.14,-45.95,;18.6,-45.95,;17.83,-47.27,;16.29,-47.27,;15.52,-45.95,;16.29,-44.61,;17.83,-44.61,;25.53,-44.63,;27.07,-44.64,;34.76,-47.37,;33.26,-47.76,;34.35,-48.85,;36.3,-47.38,;37.07,-46.06,;38.61,-46.08,;39.37,-47.42,;38.58,-48.75,;37.05,-48.73,)|
CN[C@H]1CC[C@@H](CC1)c1ccc(OCCCN2CCCCC2)cc1 |r,wU:2.1,wD:5.8,(11.63,-46.17,;10.84,-47.5,;9.3,-47.49,;8.52,-48.81,;6.99,-48.8,;6.23,-47.46,;7,-46.13,;8.54,-46.15,;4.68,-47.45,;3.9,-48.77,;2.37,-48.77,;1.61,-47.43,;.07,-47.42,;-.71,-48.76,;-2.25,-48.75,;-3.01,-47.42,;-4.55,-47.42,;-5.32,-48.74,;-6.86,-48.74,;-7.63,-47.42,;-6.86,-46.08,;-5.32,-46.08,;2.37,-46.1,;3.92,-46.11,)|
CCCCN[C@H]1CC[C@@H](CC1)c1ccc(OCCCN2CCCCC2)cc1 |r,wU:5.4,wD:8.11,(39.04,-38.4,;37.5,-38.39,;36.72,-39.72,;35.18,-39.7,;34.4,-41.03,;32.86,-41.01,;32.07,-42.34,;30.54,-42.33,;29.78,-40.99,;30.55,-39.66,;32.09,-39.67,;28.23,-40.97,;27.45,-42.3,;25.92,-42.3,;25.16,-40.95,;23.62,-40.95,;22.85,-42.28,;21.31,-42.28,;20.54,-40.95,;19,-40.95,;18.23,-42.27,;16.69,-42.27,;15.92,-40.95,;16.69,-39.61,;18.23,-39.61,;25.92,-39.63,;27.47,-39.64,)|
CCCCN[C@H]1CC[C@H](CC1)c1ccc(OCCCN2CCCCC2)cc1 |r,wU:8.11,5.4,(13.77,-38.89,;12.23,-38.87,;11.45,-40.2,;9.91,-40.18,;9.13,-41.51,;7.59,-41.5,;6.8,-42.82,;5.27,-42.81,;4.51,-41.47,;5.28,-40.14,;6.82,-40.16,;2.96,-41.46,;2.18,-42.79,;.65,-42.78,;-.11,-41.44,;-1.65,-41.43,;-2.42,-42.77,;-3.96,-42.76,;-4.73,-41.43,;-6.27,-41.43,;-7.04,-42.75,;-8.58,-42.75,;-9.35,-41.43,;-8.58,-40.09,;-7.04,-40.09,;.65,-40.11,;2.2,-40.12,)|
C(COc1ccc(cc1)[C@H]1CC[C@@H](CC1)NCc1ccccc1)CN1CCCCC1 |r,wU:12.16,wD:9.9,(-6.54,-1.94,;-5,-1.94,;-4.23,-.6,;-2.69,-.6,;-1.93,-1.95,;-.39,-1.96,;.39,-.63,;-.38,.71,;-1.92,.72,;1.93,-.63,;2.69,-1.98,;4.22,-1.99,;5,-.67,;4.24,.68,;2.7,.69,;6.54,-.67,;7.31,.66,;8.85,.66,;9.62,-.68,;11.16,-.68,;11.93,.65,;11.15,1.99,;9.62,1.98,;-7.31,-.6,;-8.85,-.6,;-9.62,-1.93,;-11.16,-1.93,;-11.93,-.6,;-11.16,.73,;-9.62,.73,)|
C(COc1ccc(cc1)[C@@H]1CC[C@@H](CC1)NCc1ccccc1)CN1CCCCC1 |r,wU:9.9,12.16,(-6.54,-1.94,;-5,-1.94,;-4.23,-.6,;-2.69,-.6,;-1.93,-1.95,;-.39,-1.96,;.39,-.63,;-.38,.71,;-1.92,.72,;1.93,-.63,;2.69,-1.98,;4.22,-1.99,;5,-.67,;4.24,.68,;2.7,.69,;6.54,-.67,;7.31,.66,;8.85,.66,;9.62,-.68,;11.16,-.68,;11.93,.65,;11.15,1.99,;9.62,1.98,;-7.31,-.6,;-8.85,-.6,;-9.62,-1.93,;-11.16,-1.93,;-11.93,-.6,;-11.16,.73,;-9.62,.73,)|
C(COc1ccc(cc1)[C@H]1CC[C@@H](CC1)N1Cc2ccccc2C1)CN1CCCCC1 |r,wU:12.16,wD:9.9,(21.26,-32.26,;22.8,-32.26,;23.57,-30.93,;25.11,-30.93,;25.87,-32.27,;27.41,-32.28,;28.19,-30.95,;27.42,-29.61,;25.88,-29.6,;29.73,-30.96,;30.49,-32.3,;32.02,-32.32,;32.81,-30.99,;32.05,-29.65,;30.5,-29.63,;34.35,-31,;35.24,-32.26,;36.71,-31.79,;38.03,-32.57,;39.37,-31.82,;39.38,-30.27,;38.06,-29.5,;36.72,-30.25,;35.26,-29.76,;20.49,-30.92,;18.95,-30.92,;18.18,-32.25,;16.64,-32.25,;15.87,-30.92,;16.64,-29.59,;18.18,-29.59,)|
C(COc1ccc(cc1)[C@@H]1CC[C@@H](CC1)N1Cc2ccccc2C1)CN1CCCCC1 |r,wU:9.9,12.16,(-4.94,-32.61,;-3.4,-32.61,;-2.63,-31.28,;-1.09,-31.28,;-.33,-32.62,;1.2,-32.63,;1.98,-31.3,;1.22,-29.96,;-.33,-29.95,;3.53,-31.31,;4.29,-32.65,;5.82,-32.67,;6.61,-31.34,;5.84,-30,;4.3,-29.98,;8.15,-31.35,;9.04,-32.61,;10.5,-32.14,;11.83,-32.92,;13.17,-32.17,;13.18,-30.62,;11.85,-29.85,;10.52,-30.6,;9.06,-30.11,;-5.71,-31.27,;-7.25,-31.27,;-8.02,-32.6,;-9.56,-32.6,;-10.33,-31.27,;-9.56,-29.94,;-8.02,-29.94,)|
OC1CCN(CC1)[C@H]1CC[C@@H](CC1)c1ccc(OCCCN2CCCCC2)cc1 |r,wU:7.7,wD:10.14,(38.79,-26.58,;37.25,-26.57,;36.46,-27.89,;34.93,-27.87,;34.18,-26.53,;34.95,-25.2,;36.5,-25.22,;32.64,-26.51,;31.85,-27.84,;30.32,-27.83,;29.56,-26.49,;30.33,-25.16,;31.88,-25.17,;28.02,-26.47,;27.24,-27.8,;25.71,-27.8,;24.94,-26.45,;23.4,-26.45,;22.63,-27.78,;21.09,-27.78,;20.33,-26.45,;18.79,-26.44,;18.02,-27.77,;16.48,-27.77,;15.71,-26.44,;16.48,-25.11,;18.02,-25.11,;25.71,-25.13,;27.25,-25.14,)|
OC1CCN(CC1)[C@H]1CC[C@H](CC1)c1ccc(OCCCN2CCCCC2)cc1 |r,wU:10.14,7.7,(13.04,-26.41,;11.5,-26.39,;10.71,-27.72,;9.17,-27.7,;8.42,-26.36,;9.2,-25.03,;10.74,-25.05,;6.88,-26.34,;6.1,-27.67,;4.57,-27.66,;3.81,-26.32,;4.58,-24.99,;6.12,-25,;2.26,-26.3,;1.48,-27.63,;-.05,-27.62,;-.81,-26.28,;-2.35,-26.28,;-3.12,-27.61,;-4.66,-27.61,;-5.43,-26.28,;-6.97,-26.27,;-7.74,-27.6,;-9.27,-27.6,;-10.05,-26.27,;-9.27,-24.94,;-7.74,-24.94,;-.05,-24.96,;1.5,-24.96,)|
C(COc1ccc(cc1)[C@H]1CC[C@@H](CC1)N1CCOCC1)CN1CCCCC1 |r,wU:12.16,wD:9.9,(21.81,-23.48,;23.35,-23.48,;24.12,-22.15,;25.66,-22.15,;26.43,-23.49,;27.96,-23.5,;28.74,-22.17,;27.97,-20.83,;26.43,-20.82,;30.28,-22.18,;31.04,-23.52,;32.58,-23.53,;33.36,-22.21,;32.6,-20.87,;31.05,-20.85,;34.9,-22.22,;35.65,-23.56,;37.19,-23.58,;37.97,-22.26,;37.22,-20.92,;35.67,-20.9,;21.04,-22.14,;19.5,-22.14,;18.74,-23.47,;17.2,-23.47,;16.42,-22.14,;17.2,-20.8,;18.74,-20.8,)|
C(COc1ccc(cc1)[C@@H]1CC[C@@H](CC1)N1CCOCC1)CN1CCCCC1 |r,wU:9.9,12.16,(-3.9,-23.3,;-2.36,-23.3,;-1.59,-21.97,;-.05,-21.97,;.71,-23.31,;2.25,-23.32,;3.03,-21.99,;2.26,-20.65,;.71,-20.64,;4.57,-22,;5.33,-23.34,;6.86,-23.36,;7.65,-22.03,;6.89,-20.69,;5.34,-20.67,;9.19,-22.04,;9.94,-23.38,;11.47,-23.4,;12.26,-22.08,;11.5,-20.74,;9.96,-20.72,;-4.67,-21.96,;-6.21,-21.96,;-6.98,-23.29,;-8.52,-23.29,;-9.29,-21.96,;-8.52,-20.63,;-6.98,-20.63,)|
CN1CCN(CC1)[C@H]1CC[C@@H](CC1)c1ccc(OCCCN2CCCCC2)cc1 |r,wU:7.7,wD:10.14,(38.82,-17.68,;37.28,-17.66,;36.49,-18.99,;34.95,-18.97,;34.2,-17.63,;34.98,-16.3,;36.52,-16.32,;32.66,-17.61,;31.88,-18.94,;30.34,-18.93,;29.58,-17.59,;30.35,-16.26,;31.9,-16.27,;28.04,-17.57,;27.26,-18.9,;25.73,-18.89,;24.96,-17.55,;23.42,-17.55,;22.65,-18.88,;21.11,-18.88,;20.34,-17.54,;18.8,-17.54,;18.04,-18.87,;16.5,-18.87,;15.72,-17.54,;16.5,-16.21,;18.04,-16.21,;25.73,-16.22,;27.27,-16.23,)|
CN1CCN(CC1)[C@H]1CC[C@H](CC1)c1ccc(OCCCN2CCCCC2)cc1 |r,wU:10.14,7.7,(12.69,-18.09,;11.15,-18.07,;10.36,-19.4,;8.83,-19.38,;8.07,-18.04,;8.85,-16.71,;10.39,-16.73,;6.53,-18.02,;5.75,-19.35,;4.22,-19.34,;3.46,-18,;4.23,-16.67,;5.77,-16.68,;1.91,-17.98,;1.13,-19.31,;-.4,-19.31,;-1.16,-17.96,;-2.7,-17.96,;-3.47,-19.29,;-5.01,-19.29,;-5.78,-17.96,;-7.32,-17.95,;-8.09,-19.28,;-9.63,-19.28,;-10.4,-17.95,;-9.63,-16.62,;-8.09,-16.62,;-.4,-16.63,;1.15,-16.64,)|
CC1CCN(CC1)[C@H]1CC[C@H](CC1)c1ccc(OCCCN2CCCCC2)cc1 |r,wU:10.14,7.7,(24.57,-13.55,;23.03,-13.53,;22.24,-14.85,;20.71,-14.83,;19.96,-13.49,;20.73,-12.16,;22.28,-12.18,;18.42,-13.48,;17.64,-14.8,;16.1,-14.79,;15.34,-13.45,;16.11,-12.12,;17.66,-12.14,;13.8,-13.44,;13.02,-14.76,;11.49,-14.76,;10.72,-13.42,;9.19,-13.41,;8.41,-14.75,;6.87,-14.74,;6.11,-13.41,;4.57,-13.41,;3.8,-14.73,;2.26,-14.73,;1.49,-13.41,;2.26,-12.07,;3.8,-12.07,;11.49,-12.09,;13.03,-12.1,)|
C(COc1ccc(cc1)[C@H]1CC[C@@H](CC1)N1CCCC1)CN1CCCCC1 |r,wU:12.16,wD:9.9,(16.8,-5.71,;18.34,-5.71,;19.11,-4.38,;20.65,-4.38,;21.42,-5.73,;22.95,-5.73,;23.73,-4.4,;22.96,-3.07,;21.42,-3.06,;25.27,-4.42,;26.03,-5.76,;27.57,-5.77,;28.35,-4.44,;27.59,-3.1,;26.05,-3.09,;29.89,-4.46,;30.79,-5.71,;32.25,-5.25,;32.27,-3.71,;30.81,-3.22,;16.03,-4.38,;14.49,-4.37,;13.73,-5.7,;12.19,-5.7,;11.41,-4.37,;12.19,-3.04,;13.73,-3.04,)|
C(COc1ccc(cc1)[C@@H]1CC[C@@H](CC1)N1CCCC1)CN1CCCCC1 |r,wU:9.9,12.16,(-5.18,-6.04,;-3.64,-6.04,;-2.87,-4.71,;-1.33,-4.71,;-.56,-6.05,;.97,-6.06,;1.75,-4.73,;.98,-3.39,;-.56,-3.38,;3.29,-4.74,;4.05,-6.09,;5.59,-6.1,;6.37,-4.77,;5.61,-3.43,;4.07,-3.41,;7.91,-4.78,;8.81,-6.04,;10.27,-5.57,;10.29,-4.03,;8.83,-3.54,;-5.95,-4.7,;-7.49,-4.7,;-8.25,-6.03,;-9.79,-6.03,;-10.57,-4.7,;-9.79,-3.37,;-8.25,-3.37,)|
C(COc1ccc(cc1)[C@H]1CC[C@@H](CC1)N1CCC1)CN1CCCCC1 |r,wU:12.16,wD:9.9,(16.79,-1.47,;18.33,-1.47,;19.11,-.14,;20.65,-.14,;21.41,-1.49,;22.94,-1.49,;23.72,-.16,;22.96,1.17,;21.41,1.18,;25.27,-.18,;26.03,-1.52,;27.56,-1.53,;28.34,-.2,;27.58,1.14,;26.04,1.15,;29.88,-.22,;30.96,-1.32,;32.06,-.24,;30.98,.86,;16.03,-.14,;14.49,-.14,;13.72,-1.46,;12.18,-1.46,;11.41,-.14,;12.18,1.2,;13.72,1.2,)|
C(COc1ccc(cc1)[C@@H]1CC[C@@H](CC1)N1CCC1)CN1CCCCC1 |r,wU:9.9,12.16,(-5.54,-1.1,;-4,-1.1,;-3.23,.23,;-1.69,.23,;-.93,-1.11,;.61,-1.12,;1.38,.21,;.62,1.55,;-.93,1.56,;2.93,.19,;3.69,-1.15,;5.22,-1.16,;6.01,.17,;5.25,1.51,;3.7,1.52,;7.55,.15,;8.62,-.94,;9.72,.13,;8.64,1.23,;-6.31,.24,;-7.85,.24,;-8.62,-1.09,;-10.16,-1.09,;-10.93,.24,;-10.16,1.57,;-8.62,1.57,)|
CN(C)[C@H]1CC[C@@H](CC1)c1ccc(OCCCN2CCCCC2)cc1 |r,wU:3.2,wD:6.9,(46.41,2.61,;45.65,3.95,;46.43,5.28,;44.11,3.96,;43.33,2.64,;41.79,2.65,;41.03,3.99,;41.8,5.32,;43.35,5.3,;39.49,4,;38.71,2.68,;37.18,2.68,;36.41,4.02,;34.87,4.03,;34.1,2.69,;32.56,2.7,;31.79,4.03,;30.25,4.03,;29.49,2.71,;27.95,2.71,;27.17,4.03,;27.95,5.37,;29.49,5.37,;37.18,5.35,;38.72,5.34,)|
O=C1CCC(CC1)c1ccc(OCCCN2CCCCC2)cc1
C(COc1ccc(cc1)[C@H]1CC[C@@H](CC1)N1CCCCC1)CN1CCCCC1 |r,wU:12.16,wD:9.9,(6.96,-10.59,;8.5,-10.59,;9.27,-9.26,;10.81,-9.26,;11.58,-10.6,;13.11,-10.61,;13.89,-9.28,;13.13,-7.94,;11.58,-7.93,;15.43,-9.29,;16.2,-10.64,;17.73,-10.65,;18.51,-9.32,;17.75,-7.98,;16.21,-7.96,;20.05,-9.33,;20.81,-10.68,;22.34,-10.69,;23.13,-9.37,;22.37,-8.03,;20.83,-8.01,;6.19,-9.25,;4.65,-9.25,;3.89,-10.58,;2.35,-10.58,;1.57,-9.25,;2.35,-7.92,;3.89,-7.92,)|
COC(=O)c1cc(on1)-c1ccc2cc(CCN3CCC[C@H]3C)ccc2n1 |r|
COC(=O)c1c(C)noc1-c1ccc2cc(CCN3CCC[C@H]3C)ccc2n1 |r|
CCOC(=O)c1ccc(cc1)-c1ccc(OCCCN2CCCCC2)cc1
O=C(N1CCCCC1)c1ccccc1-c1ccc(OCCCN2CCCCC2)cc1
COc1ccccc1-c1ccc(OCCCN2CCCCC2)cc1
C(COc1ccc(cc1)-c1ccc2OCOc2c1)CN1CCCCC1
C(COc1ccc(cc1)C1CCOCC1)CN1CCCCC1
C(COc1ccc(cc1)C1CCCCO1)CN1CCCCC1
C(COc1ccc(cc1)N1CCCCC1)CN1CCCCC1
C(COc1ccc(cc1)C1CCCCC1)CN1CCCCC1
C[C@H]1[C@@H](Oc2ccccc2S1(=O)=O)c1ccc(OCCCN2CCCC2)cc1 |r|
C(COc1ccc(cc1)-c1ccccc1)CN1CCCCC1
CC(C)N1CCN(CC1)C(=C)N(C)Cc1ccc(cc1)-c1ccccc1
COCC1CCCN1S(=O)(=O)c1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)N1CCC(O)C1 |r|
COC1CCN(CC1)S(=O)(=O)c1ccc(cc1)-c1ccc(CCN2CCCC2C)cc1
CC1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)N1CCS(=O)(=O)CC1
CC1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)N1C(C)COCC1C
CC1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NCc1ccncc1
CC1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NCc1ccccc1
CC1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)Nc1ccccc1
CC1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NC1CCC1
CC1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NCC1CC1
CCC(CO)NS(=O)(=O)c1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
CC1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(N)(=O)=O
CC1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)N1CCCCC1
CCCNS(=O)(=O)c1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
COC(=O)N1CC(CC1C(=O)N1CCCN(CC1)C1CCC1)Oc1ccc(F)cc1
COC(=O)N1CC(CC1C(=O)N1CCCN(CC1)C1CCC1)Oc1cccc(F)c1
C(COc1ccc(cc1)C1=CCCC1)CN1CCCCC1 |t:10|
C(COc1ccc(cc1)C1=NCCO1)CN1CCCCC1 |t:10|
C(COc1ccc(cc1)-c1cnco1)CN1CCCCC1
Cn1nccc1-c1ccc(OCCCN2CCCCC2)cc1
C(COc1ccc(cc1)-c1ncc[nH]1)CN1CCCCC1
C(COc1ccc(cc1)C1CCCO1)CN1CCCCC1
C(COc1ccc(cc1)-c1ccco1)CN1CCCCC1
C(COc1ccc(cc1)-c1cccs1)CN1CCCCC1
CC(C)N1CC[C@H](C1)N(C)C(=O)c1ccc(Cn2cnc3ccccc23)cc1 |r|
CN([C@@H]1CCN(C1)C1CCC1)C(=O)c1ccc(Cn2cnc3ccccc23)cc1 |r|
CN([C@@H]1CCN(C1)C1CCCC1)C(=O)c1ccc(Cn2cnc3ccccc23)cc1 |r|
CC(C)N1CC[C@H](C1)N(C)C(=O)c1ccc(cc1)-n1cccn1 |r|
CN([C@@H]1CCN(C1)C1CCC1)C(=O)c1ccc(cc1)-n1cccn1 |r|
CN([C@@H]1CCN(C1)C1CCCC1)C(=O)c1ccc(cc1)-n1cccn1 |r|
CC(C)N1CC[C@H](C1)N(C)C(=O)c1ccc(Cn2cccn2)cc1 |r|
CN([C@@H]1CCN(C1)C1CCC1)C(=O)c1ccc(Cn2cccn2)cc1 |r|
CN([C@@H]1CCN(C1)C1CCCC1)C(=O)c1ccc(Cn2cccn2)cc1 |r|
Cc1nc2ccccc2n1-c1ccc(cc1)C(=O)N1CC[C@@H](C1)N1CCCC1 |r|
CN([C@@H]1CCNC1)C(=O)c1ccc(cc1)-n1c(C)nc2ccccc12 |r|
CN([C@@H]1CCN(C)C1)C(=O)c1ccc(cc1)-n1c(C)nc2ccccc12 |r|
CCCN1CC[C@H](C1)N(C)C(=O)c1ccc(cc1)-n1c(C)nc2ccccc12 |r|
CC(C)N1CC[C@H](C1)N(C)C(=O)c1ccc(cc1)-n1c(C)nc2ccccc12 |r|
CC(C)N1CC[C@@H](C1)N(C)C(=O)c1ccc(cc1)-n1c(C)nc2ccccc12 |r|
CN([C@@H]1CCN(C1)C1CCC1)C(=O)c1ccc(cc1)-n1c(C)nc2ccccc12 |r|
CN([C@H]1CCN(C1)C1CCC1)C(=O)c1ccc(cc1)-n1c(C)nc2ccccc12 |r|
CN([C@@H]1CCN(C1)C1CCCC1)C(=O)c1ccc(cc1)-n1c(C)nc2ccccc12 |r|
CN([C@H]1CCN(C1)C1CCCC1)C(=O)c1ccc(cc1)-n1c(C)nc2ccccc12 |r|
CN([C@@H]1CCN(C1)C1CCCCC1)C(=O)c1ccc(cc1)-n1c(C)nc2ccccc12 |r|
CN([C@H]1CCN(C1)C1CCCCC1)C(=O)c1ccc(cc1)-n1c(C)nc2ccccc12 |r|
CN([C@@H]1CCN(C1)C1CCCCCC1)C(=O)c1ccc(cc1)-n1c(C)nc2ccccc12 |r|
CC(C)N1CC[C@H](C1)NC(=O)c1ccc(cc1)-n1c(C)nc2ccccc12 |r|
CCN([C@@H]1CCN(C1)C(C)C)C(=O)c1ccc(cc1)-n1c(C)nc2ccccc12 |r|
CCN([C@@H]1CCN(C1)C1CCC1)C(=O)c1ccc(cc1)-n1c(C)nc2ccccc12 |r|
Cc1nc2ccccc2n1-c1ccc(cc1)C(=O)N[C@@H]1CCN(C1)C1CCCC1 |r|
CCN([C@@H]1CCN(C1)C1CCCC1)C(=O)c1ccc(cc1)-n1c(C)nc2ccccc12 |r|
CC(C)N1CC[C@H](C1)N(C)C(=O)c1ccc(Cn2c(C)nc3ccccc23)cc1 |r|
CN([C@@H]1CCN(C1)C1CCCC1)C(=O)c1ccc(Cn2c(C)nc3ccccc23)cc1 |r|
CCN1CC[C@H](C1)N(C)C(=O)c1ccc(cc1)-n1c(C)nc2ccccc12 |r|
CN([C@@H]1CCN(C1)C1CCC1)C(=O)c1ccc(Cn2c(C)nc3ccccc23)cc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(=O)n(C)n1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(=O)[nH]n1 |r|
Cn1nc(ccc1=O)-c1ccc(CCN2CCCC2)cc1
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(=O)n(n1)-c1ccccc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(=O)n(n1)-c1ccc(F)cc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(=O)n(n1)-c1ccc(Cl)cc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(=O)n(Cc2ccccc2)n1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(=O)n(n1)-c1ccccn1 |r|
COc1cccc(c1)C(O)(COc1ccccc1C)CN1CCN(C)CC1
CC(C)(C)CCNc1cc(N[C@H]2CCNC2)ncn1 |r|
CC(C)(C)CCNc1cc(N[C@@H]2CCNC2)ncn1 |r|
CN1CCN(CC1)c1cc(NCC(C)(C)C)ncn1
CN(C)[C@@H]1CCN(C1)c1cc(NCC(C)(C)C)ncn1 |r|
CN1CCN(CC1)c1cc(NCCC(C)(C)C)ncn1
C(Cn1cnn2c3ccccc3nc12)N1CCCCC1
C1CCC(C1)N1CCN(CC1)c1ncnc2ccccc12
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1ccc(=O)n(C)c1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1ccc(=O)[nH]c1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1ccn(C)c(=O)c1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1cccc(=O)n1C |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1cccn(C)c1=O |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1ccc(=O)n(c1)-c1ccccc1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1ccc(=O)n(c1)-c1ccc(F)cc1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1ccc(=O)n(Cc2ccccc2)c1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1cc(C#N)c(=O)n(C)c1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1cc(-c2ccccc2)c(=O)n(C)c1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1cn(C)c(=O)c2ccccc12 |r|
C[C@@H]1CCCN1CCCOc1cccc(c1)-c1ccc(=O)n(C)c1 |r|
Nc1nc2ccccc2nc1NCCOc1ccc(CN2CCCCC2)cc1
CCN(CC)Cc1ccc(OCCNc2nc3ccccc3nc2N)cc1
Nc1nc2ccccc2nc1CNc1ccc(CN2CCCCC2)cc1
C[C@@H]1CCCN1CCCOc1ccc(cc1)C1=NNC(=O)CC1 |r,t:18|
C[C@H]1CCCN1CCCOc1ccc(cc1)C1=NNC(=O)CC1 |r,t:18|
O=C1CCC(=NN1)c1ccc(OCCCN2CCCC2)cc1 |c:4|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C1=NN(C)C(=O)CC1 |r,t:18|
CC(C)N1N=C(CCC1=O)c1ccc(OCCCN2CCC[C@H]2C)cc1 |r,c:4|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C1=NN(CC(F)(F)F)C(=O)CC1 |r,t:18|
FC(F)(F)CN1N=C(CCC1=O)c1ccc(OCCCN2CCCCC2)cc1 |c:6|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C1=NN(C(=O)CC1)c1ccccc1 |r,t:18|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C1=NN(Cc2ccccc2)C(=O)CC1 |r,t:18|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C1=NN(C(=O)CC1)c1ccccn1 |r,t:18|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C1=NNC(=O)C(C)C1 |r,t:18|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C1=NNC(=O)CC1C |r,t:18|
CC1CC(=O)NN=C1c1ccc(OCCCN2CCCC2)cc1 |c:6|
CC1CC(=O)NN=C1c1ccc(OCCCN2CCCCC2)cc1 |c:6|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C1=NNC(=O)C(C)(C)C1 |r,t:18|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C1=NNC(=O)CC1(C)C |r,t:18|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C1=NNC(=O)C(C1)c1ccccn1 |r,t:18|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C1=NNC(=O)CC1c1ccccn1 |r,t:18|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1n[nH]c(=O)cc1C |r|
C(Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1)C1CCCO1
C1CC(C1)N1CCC2(CC1)CCc1cc(OC3CCOCC3)ccc1O2
C1CC(C1)N1CCC2(CC1)CCc1cc(OC3CCSCC3)ccc1O2
C(Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1)C1CCSCC1
O=S1(=O)CCC(C1)Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1
O=S1(=O)CCC(CC1)Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1
O=S1(=O)CCC(COc2ccc3OC4(CCN(CC4)C4CCC4)CCc3c2)CC1
OCCOc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1
CC(O)COc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1
CC[C@@H](O)COc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 |r|
CC[C@H](O)COc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1 |r|
CC(C)(O)COc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1
COCCOc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1
CSCCOc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1
CSCCCOc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1
CS(=O)(=O)CCOc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1
CS(=O)(=O)CCCOc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1
C1CC(C1)N1CCC2(CC1)CCc1cc(O[C@@H]3CCOC3)ccc1O2 |r|
C1CC(C1)N1CCC2(CC1)CCc1cc(O[C@H]3CCOC3)ccc1O2 |r|
C1CC(C1)N1CCC2(CC1)CCc1cc(OC3CCSC3)ccc1O2
C(Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1)C1CCOC1
Nc1nc(N2CCNCC2)c2ccc(cc2n1)-c1ccco1
CN1CCN(CC1)c1nc(N)nc2cc(ccc12)-c1ccoc1
CN1CCN(CC1)c1nc(N)nc2cc(ccc12)-c1ccsc1
CN1CCN(CC1)c1nc(N)nc2cc(ccc12)-c1ccco1
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(C)(=O)=O |r|
CCS(=O)(=O)c1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
CCCS(=O)(=O)c1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
CC(C)S(=O)(=O)c1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)Cc1ccccc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)C1CCCC1 |r|
COCCS(=O)(=O)c1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)CCO |r|
CCOCCS(=O)(=O)c1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
COCCCS(=O)(=O)c1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)CCCO |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)CC1CCOCC1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)C1CCOCC1 |r|
C[C@@H]1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)CC1CCCCO1 |r|
COCS(=O)(=O)c1ccc(cc1)-c1ccc(CCN2CCC[C@H]2C)cc1 |r|
COCCS(=O)(=O)c1ccc(cc1)-c1ccc(CCN2CCC[C@@H]2C)cc1 |r|
CN1CCN(CC1)C(=O)c1cn2cc(Cl)ccc2n1
CN1CCN(CC1)C(=O)c1cc2cccnc2[nH]1
CN1C[C@H]2CN(C[C@H]2C1)C(=O)c1cc2cc(Cl)ccc2[nH]1 |r|
CN1C[C@H]2CN(C[C@H]2C1)C(=O)c1nc2ccc(F)cc2[nH]1 |r|
CN1C[C@H]2CN(C[C@H]2C1)C(=O)c1nc2cc(F)c(F)cc2[nH]1 |r|
CN1C[C@H]2CN(C[C@H]2C1)C(=N)c1nc2cc(F)c(F)cc2[nH]1 |r|
CN1C[C@H]2CN(C[C@H]2C1)C(=N)c1nc2ccc(F)cc2[nH]1 |r|
CN1C[C@H]2CN(C[C@H]2C1)C(=N)c1nc2c(F)c(F)c(F)cc2[nH]1 |r|
CN1C[C@H]2CN(C[C@H]2C1)C(=N)c1nc2ccccc2[nH]1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1cn[nH]c(=O)c1 |r|
Cc1n[nH]c(=O)cc1-c1ccc(OC2CCN(CC2)C2CCC2)cc1
O=c1cc(cn[nH]1)-c1ccc(OC2CCN(CC2)C2CCC2)nc1
Cc1nn(-c2ccsc2)c(=O)cc1-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cc1cccnc1-n1nc(C)c(cc1=O)-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cc1cccc(n1)-n1nc(C)c(cc1=O)-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cc1nn(-c2ccccn2)c(=O)cc1-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cc1nn(C)c(=O)cc1-c1ccc(OC2CCN(CC2)C2CCC2)cc1
CC1=NNC(=O)CC1c1ccc(OC2CCN(CC2)C2CCC2)cc1 |t:1|
O=c1cc(cn[nH]1)-c1ccc(OC2CCN(CC2)C2CCC2)cc1
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1cnn(-c2ccccn2)c(=O)c1 |r|
C[C@H]1CC(=O)NN=C1c1ccc(OC2CCN(CC2)C2CCC2)cc1 |r,c:6|
C[C@@H]1CC(=O)NN=C1c1ccc(OC2CCN(CC2)C2CCC2)cc1 |r,c:6|
O=c1ccc(n[nH]1)-c1ccc(OC2CCN(CC2)C2CCC2)cc1
CC1(C)CC(=NNC1=O)c1ccc(OC2CCN(CC2)C2CCC2)cc1 |c:4|
Cc1cc(=O)[nH]nc1-c1ccc(OC2CCN(CC2)C2CCC2)cc1
O=c1ccc(nn1-c1ccccn1)-c1ccc(OC2CCN(CC2)C2CCC2)cc1
Cn1nc(ccc1=O)-c1ccc(OC2CCN(CC2)C2CCCC2)cc1
Cn1nc(ccc1=O)-c1ccc(OC2CCN(CC2)C2CCC2)cc1
CC(C)N1CCC(CC1)Oc1ccc(cc1)-c1ccc(=O)n(C)n1
Cn1nc(ccc1=O)-c1ccc(OC2CCNCC2)cc1
O=c1ccc(n[nH]1)-c1ccc(OC2CCN(CC2)C2CCCC2)cc1
CC1(C)CC(=NNC1=O)c1ccc(OC2CCN(CC2)C2CCC2)c(F)c1 |c:4|
CC1(C)CC(=NNC1=O)c1ccc(OC2CCN(CC2)C2CCC2)nc1 |c:4|
O=C1CCC(=NN1)c1ccc(OC2CCN(CC2)C2CCC2)cc1 |c:4|
O=c1ccc(nn1-c1ccccn1)-c1ccc(OC2CCN(CC2)C2CCC2)nc1
CC(C)n1nc(ccc1=O)-c1ccc(OC2CCN(CC2)C2CCC2)nc1
Cn1nc(ccc1=O)-c1ccc(OC2CCN(CC2)C2CCCC2)nc1
Cn1nc(ccc1=O)-c1ccc(OC2CCN(CC2)C2CCC2)nc1
O=c1ccc(n[nH]1)-c1ccc(OC2CCN(CC2)C2CCCC2)nc1
O=c1ccc(n[nH]1)-c1ccc(OC2CCN(CC2)C2CCC2)nc1
CC(C)N1CCC(CC1)Oc1ccc(cn1)-c1ccc(=O)[nH]n1
C[C@@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1CCOCC1 |r|
O=C(CN1CCCCC1)c1ccc(OCCCN2CCCC2)cc1
O=C(CN1CCOCC1)c1ccc(OCCCN2CCCC2)cc1
O=C(CN1CCOCC1)c1ccc(OCCCN2CCCCC2)cc1
C[C@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1CCOCC1 |r|
CC1(C)CCCN1CCCOc1ccc(cc1)C(=O)CN1CCOCC1
COC[C@@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1CCOCC1 |r|
COC[C@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1CCOCC1 |r|
CC(N1CCOCC1)C(=O)c1ccc(OCCCN2CCC[C@H]2C)cc1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C(=O)C(C)(C)N1CCOCC1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1C[C@H](C)O[C@H](C)C1 |r|
C[C@@H]1CCCN1CCCOc1ccc(C(=O)CN2CCOCC2)c(C)c1 |r|
C=Cc1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
CC(=O)Nc1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
C[C@@H]1CCCN1c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1 |r|
C1N(Cc2ccccc12)c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
COc1ccnc2c(cccc12)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
C1CCN(CC1)C1CCN(CC1)c1nc2ncc(cc2o1)-c1cccc2cccnc12
Cc1nnc2ccc(cn12)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
O=c1ccnc2ccc(cn12)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
O=c1ccnc2c(cccn12)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
C1CCN(CC1)C1CCN(CC1)c1nc2ncc(cc2o1)-c1cccc2ccnn12
C1CCN(CC1)C1CCN(CC1)c1nc2ncc(cc2o1)-c1cnc2cnccn12
C1CCN(CC1)C1CCN(CC1)c1nc2ncccc2o1
Brc1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
C1CCN(CC1)C1CCN(CC1)c1nc2ncc(cc2o1)C1CCN(CC1)c1ncccn1
OCc1cccc(c1)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
CC(C)C(O)c1cccc(c1)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
CC(=O)Nc1ccc(cc1)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
CC(=O)Nc1ccccc1-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
NC(=O)c1ccc(cc1)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
FC(F)(F)c1ccc(cc1)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
O=Cc1cccc(c1)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
Fc1ccc(cc1C#N)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
N#Cc1ccc(cc1)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
C1CCN(CC1)C1CCN(CC1)c1nc2ncc(cc2o1)-c1cccnc1
C1CCN(CC1)C1CCN(CC1)c1nc2ncc(cc2o1)-c1ccncc1
C1CCN(CC1)C1CCN(CC1)c1nc2ncc(cc2o1)-c1ccccn1
N#Cc1cncc(c1)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
Nc1ccc(cn1)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
Fc1ccc(cn1)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
Cc1cc(ccn1)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
COc1cc(ccn1)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
COc1cccc(n1)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
Clc1cccc(n1)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
Cc1cccc(n1)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
Cc1cccnc1-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
FC(F)(F)c1cccc(n1)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
CCc1cccc(n1)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
C1CCN(CC1)C1CCN(CC1)c1nc2ncc(cc2o1)-c1cccc2OCCOc12
O=C1Cc2cc(ccc2N1)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
O=c1[nH]cnc2cc(ccc12)-c1cnc2nc(oc2c1)N1CCC(CC1)N1CCCCC1
O=C(Cc1ccccc1)c1ccc(OCCCc2cnc[nH]2)cc1
CC(C)(C)CC(=O)c1ccc(OCCCc2cnc[nH]2)cc1
O=Cc1ccc(OCCCc2cnc[nH]2)cc1
C(COc1ccc2CCCc2c1)Cc1cnc[nH]1
CCCCC(=O)c1ccc(OCCCc2cnc[nH]2)cc1
CC(=O)c1c(C)cc(OCCCc2cnc[nH]2)cc1C
CCC(=O)c1ccc(OCCCc2cnc[nH]2)cc1F
O=C(C1CCC1)c1ccc(OCCCc2cnc[nH]2)cc1
CCCCCC(=O)c1ccc(OCCCc2cnc[nH]2)cc1
CCCC(=O)c1ccc(OCCCc2cnc[nH]2)cc1
CC(=O)c1ccc(OCCCc2cnc[nH]2)cc1C
O=CC=Cc1ccc(OCCCc2cnc[nH]2)cc1 |w:2.1|
CC(=O)c1ccc(OCCCc2cnc[nH]2)cc1F
CC(=O)c1ccc(OCCCc2cnc[nH]2)cc1C(F)(F)F
Oc1ccc(OCCCc2cnc[nH]2)cc1
CC(C)C(=O)c1ccc(OCCCc2cnc[nH]2)cc1
CCOC(=O)CCCC(=O)c1ccc(OCCCc2cnc[nH]2)cc1
CC(=O)C=Cc1ccc(OCCCc2cnc[nH]2)cc1 |w:3.2|
CCC(=O)c1ccc(OCCCc2cnc[nH]2)cc1
O=C(C1CCCC1)c1ccc(OCCCc2cnc[nH]2)cc1
CC(=O)c1ccc(OCCCc2cnc[nH]2)c(C)c1
O=C1CCCc2cc(OCCCc3cnc[nH]3)ccc12
OC(=O)CCCC(=O)c1ccc(OCCCc2cnc[nH]2)cc1
CCCCCCC(=O)c1ccc(OCCCc2cnc[nH]2)cc1
CC(=O)CCc1ccc(OCCCc2cnc[nH]2)cc1
C(COc1ccc2CCCCc2c1)Cc1cnc[nH]1
O=C1CCc2cc(OCCCc3cnc[nH]3)ccc12
CC(=O)Cc1ccc(OCCCc2cnc[nH]2)cc1
CS(=O)(=O)c1ccc(OCCCc2cnc[nH]2)cc1
COc1cc(OCCCc2cnc[nH]2)ccc1C(C)=O
OCc1ccc(OCCCc2cnc[nH]2)cc1
Fc1ccc2[nH]c3CCN(CCCC(=O)c4ccc(OCCCc5cnc[nH]5)cc4)Cc3c2c1
CCN1CCN(CC1)c1cc(C)c2cc(NC(=O)\C=C\c3ccc(OC)cc3)ccc2n1
Fc1ccc(COc2ccn(-c3ccc(OCCN4CCCC4)cc3)c(=O)c2)cc1
COc1cc(ccc1OCCN1CCCC1)-n1cnc2cc(sc2c1=O)-c1ccc(Cl)cc1
[NH3+]C(CC1CCCCC1)C=CC1CC1c1cnc[nH]1 |w:9.9|
CC(C)(C)CC#CC1CC1c1cnc[nH]1
Clc1ccc(CC(=O)OCCCc2cnc[nH]2)cc1
CC(CC(C)(C)C)OCCCc1cnc[nH]1
C[C@@H](NC(=O)OCCCc1cnc[nH]1)C1CCCCC1 |r|
CC(C)(C)CCCOCCCc1cnc[nH]1
CC(C)(C)CCCCOCCCc1cnc[nH]1
O=C(NC(C1CCCCC1)c1ccccc1)OCCCc1cnc[nH]1
CC(C)(C)C(=O)OCCCc1cnc[nH]1
CC(NC(=O)OCCCc1cnc[nH]1)C(C)(C)C
CC(C)(C)CCOCCCc1cnc[nH]1
CC(NC(=O)OCCCc1cnc[nH]1)C1(C)CC1
O=C(NC(C1CC1)C1CC1)OCCCc1cnc[nH]1
CC(C)(C)CCOCCCN1CCCCC1
CC(NC(=O)OCCCc1cnc[nH]1)C1CCCCC1
C[C@@H](NC(=O)OCCCc1cnc[nH]1)C(C)(C)C |r|
CC(NC(=O)OCCCc1cnc[nH]1)C1CC1
CC(C)(C)C(NC(=O)OCCCc1cnc[nH]1)C(C)(C)C
O=C(NC(C1CC1)c1ccccc1)OCCCc1cnc[nH]1
C(Oc1ccc(cc1)C1CCCC1)c1ccc(CN2CCCCC2)cc1
C(Oc1ccc(\C=C\c2ccccc2)cc1)c1ccc(CN2CCCCC2)cc1
C(Oc1ccc(Cc2ccccc2)cc1)c1ccc(CN2CCCCC2)cc1
O=C(C1CCCC1)c1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1
C(Oc1ccc(cc1)-n1ccnc1)c1ccc(CN2CCCCC2)cc1
C(Cc1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1)c1ccccc1
CCN(CC)Cc1ccc(COc2ccc(cc2)C(C)=O)cc1
CC(C)c1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1
C(Oc1ccc2CCCCc2c1)c1ccc(CN2CCCCC2)cc1
Ic1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1
CC(=O)c1ccc(COCCCc2cnc[nH]2)cc1
CC(=O)c1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1
Fc1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1
O=C(C1CC1)c1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1
C(Oc1ccccc1)c1ccc(CN2CCCCC2)cc1
Clc1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1
C(Oc1ccc2CCCc2c1)c1ccc(CN2CCCCC2)cc1
CCCCCc1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1
Fc1cc(OCc2ccc(CN3CCCCC3)cc2)ccc1Cl
C(Oc1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1)c1ccccc1
CC(N=O)c1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1
C(Nc1ccccc1)c1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1
C(Oc1ccc(Oc2ccccc2)cc1)c1ccc(CN2CCCCC2)cc1
Brc1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1
CC(=O)c1ccc(OCc2ccc(CN3CCCCCC3)cc2)cc1
Cc1cccc(OCc2ccc(CN3CCCCC3)cc2)c1
COc1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1
CC(=O)c1ccc(OCc2ccc(CN3CCCC3)cc2)cc1
CO\N=C(/C)c1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1
CCCOc1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1
Clc1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1Cl
CCCc1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1
CCCCc1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1
Cc1cc(OCc2ccc(CN3CCCCC3)cc2)ccc1Cl
CCc1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1
Cc1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1
Cc1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1C
FC(F)(F)c1ccc(OCc2ccc(CN3CCCCC3)cc2)cc1
c1cc(cc(c1)Cl)CCNCCc2ccc3ccc(nc3c2)N
Clc1ccc(cc1)C(=O)CCC(=O)N1CCN(CC1)C1CCOCC1
Clc1ccc(cc1)C(=O)CCC(=O)N1CCN(CC1)C1CCCCCCC1
Clc1ccc(cc1)C(=O)CCC(=O)N1CCN(CC2CC2)CC1
CCC(CC)N1CCN(CC1)C(=O)Cc1ccc(OC(F)(F)F)cc1
CCC(CC)N1CCN(CC1)C(=O)Cc1ccc(cc1)C(F)(F)F
CCC(CC)N1CCN(CC1)C(=O)CCOc1ccc(cc1)C#N
CCC(CC)N1CCN(CC1)C(=O)CCC(=O)c1ccc(OC(F)(F)F)cc1
Clc1ccc(cc1)C(=O)CCC(=O)N1CCN(CC1)C1CCC1
CCC(CC)N1CCN(CC1)C(=O)CCC(=O)c1ccc(OC)c(F)c1
CCC(CC)N1CCN(CC1)C(=O)Cc1ccc(cc1)N(C)C
Clc1ccc(cc1)C(=O)CCC(=O)N1CCN(CC1)C1CC1
CCC(CC)N1CCN(CC1)C(=O)COc1ccc(OC(F)(F)F)cc1
CCC(CC)N1CCN(CC1)C(=O)Cc1ccc(cc1)C(C)=O
CCC(CC)N1CCN(CC1)C(=O)c1ccc(OC(F)(F)F)cc1
CCC(CC)N1CCN(CC1)C(=O)CCC(=O)c1ccc(cc1)C(F)(F)F
CCC(CC)N1CCN(CC1)C(=O)CCC(=O)c1ccc(Cl)cc1
CC(C)(C#C)N1CCN(CC1)C(=O)CCC(=O)c1ccc(Cl)cc1
CCC(C)(C)N1CCN(CC1)C(=O)CCC(=O)c1ccc(Cl)cc1
CC(C)N1CCN(CC1)C(=O)CCC(=O)c1ccc(Cl)cc1
CCC(CC)N1CCN(CC1)C(=O)CCOc1ccc(Cl)cc1
CCC(CC)N1CCN(CC1)C(=O)CCc1ccc(cc1)C(F)(F)F
Clc1ccc(cc1)C(=O)CCC(=O)N1CCN(CC1)C1CCCCCC1
Clc1ccc(cc1)C(=O)CCC(=O)N1CCN(CC1)C1CCCCC1
CCCC(CCC)N1CCN(CC1)C(=O)CCC(=O)c1ccc(Cl)cc1
ClC(=C)CN1CCN(CC1)C(=O)CCC(=O)c1ccc(Cl)cc1
CCC(CC)N1CCN(CC1)C(=O)CCC(=O)c1ccc(F)cc1
CCC(CC)N1CCN(CC1)C(=O)Cc1ccc(cc1)-c1ccccc1
Clc1ccc(cc1)C(NC(=O)OCCCc1c[nH]cn1)c1ccc(Cl)cc1
CC1CCCN(Cc2ccc(COc3ccc(cc3)C(C)=O)cc2)C1
[O-][N+](=O)c1cccc(c1)C(OCCCc1c[nH]cn1)c1ccccc1
Ic1ccc(cc1)C(OCCCc1c[nH]cn1)c1ccccc1
Brc1ccc(cc1)C(OCCCc1c[nH]cn1)c1ccc2ccccc2c1
Nc1ccc(NCCc2ccc(OCCCN3CCCCC3)cc2)nc1
C(COCCCc1ccc(cc1)-c1ccccc1)Cc1c[nH]cn1
O=C(\C=C\c1ccccc1)c1ccc(OCCCc2c[nH]cn2)cc1
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1cccc(CO)c1
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C(=O)c1cc(F)cc(F)c1
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C(=O)c1ccc(cc1)N(C)C
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1cccc(c1)C(C)=O
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C(=O)c1ccc(C)cc1
CCC(=O)c1cccc(c1)-c1ccc2oc(CCN3CCC[C@H]3C)cc2c1
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C(=O)c1ccccc1F
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C(=O)c1cccc(F)c1
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(CO)cc1
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C(=O)C1CC1
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1cccc(c1)C(=O)C1CC1
C[C@H]1CCCN1CCc1cc2cc(ccc2o1)-c1ccc(cc1)C#N
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1cccc(c1)C#N
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1cccc(c1)C(C)(C)O
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C(=O)c1ccc(F)c(C)c1
CC(O)c1cccc(c1)-c1ccc2oc(CCN3CCC[C@H]3C)cc2c1
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C(=O)c1ccccc1
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C(=O)c1ccc(Cl)c(C)c1
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C(=O)c1cccc(Cl)c1
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C(=O)c1ccc(F)cc1
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C(=O)c1ccc(Cl)cc1
COc1ccc(cc1)C(=O)c1ccc2oc(CCN3CCC[C@H]3C)cc2c1
CCc1nc2c(C)cc(C)nc2n1Cc1ccc(\C=C\CN2CCN(CC2)C(C)C)cc1
CNCc1cc(ccc1Oc1cccc(Cl)c1)C(=O)N1CCCN(CC1)C(C)C
CNCc1cc(ccc1Oc1ccc(SC)cc1)C(=O)N1CCCN(CC1)C(C)C
CNCc1cc(ccc1Oc1ccc(Cl)c(Cl)c1)C(=O)N1CCCN(CC1)C1CC1
CNCc1cc(ccc1Oc1ccc(F)c(Cl)c1)C(=O)N1CCCN(CC1)C1CC1
CNCc1cc(ccc1Oc1cccc(F)c1)C(=O)N1CCCN(CC1)C1CC1
CNCc1cc(ccc1Oc1cccc(Cl)c1)C(=O)N1CCCN(CC1)C1CC1
CNCc1cc(ccc1Oc1cccc(c1)C#N)C(=O)N1CCCN(CC1)C1CC1
CNCc1cc(ccc1Oc1ccc(SC(F)(F)F)cc1)C(=O)N1CCCN(CC1)C1CC1
CNCc1cc(ccc1Oc1ccc(cc1)C#N)C(=O)N1CCCN(CC1)C1CC1
CNCc1cc(ccc1Oc1ccccc1OC(F)(F)F)C(=O)N1CCCN(CC1)C1CC1
CSc1ccc(cc1)[C@@H]1CN(C)Cc2cc(OCCCN3CCOCC3)ccc12
CNCc1cc(ccc1Oc1ccc(SC)cc1)C(=O)N1CCN(CC1)C(C)C
CNCc1cc(ccc1Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCN(CC1)C1CC1
CNCc1cc(ccc1Oc1cccc(F)c1)C(=O)N1CCN(CC1)C1CC1
CNCc1cc(ccc1Oc1ccccc1)C(=O)N1CCN(CC1)C1CC1
CNCc1cc(ccc1Oc1cccc(Cl)c1)C(=O)N1CCN(CC1)C1CC1
CNCc1cc(ccc1Oc1cccc(OC)c1)C(=O)N1CCN(CC1)C(C)C
CNCc1cc(ccc1Oc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1CCCC1
CNCc1cc(ccc1Oc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1CCC1
CNCc1cc(ccc1Oc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C1CC1
CNCc1cc(ccc1Oc1ccc(Cl)cc1)C(=O)N1CCN(CC1)C(C)C
CNCc1cc(ccc1Oc1ccc(Cl)c(Cl)c1)C(=O)N1CCN(CC1)C1CCCC1
CNCc1cc(ccc1Oc1ccc(Cl)c(Cl)c1)C(=O)N1CCN(CC1)C1CCC1
CNCc1cc(ccc1Oc1ccc(Cl)c(Cl)c1)C(=O)N1CCN(CC1)C(C)C
CNCc1cc(ccc1Oc1ccc(SC)c(C)c1)C(=O)N1CCN(CC1)C1CC1
CNCc1cc(ccc1Oc1ccc(SC)c(C)c1)C(=O)N1CCN(CC1)C(C)C
CNCc1cc(ccc1Oc1ccc(SC)cc1)C(=O)N1CCN(CC1)C1CC1
CNCc1cc(ccc1Oc1ccc(Cl)cc1)C(=O)N1CCCN(CC1)C(C)C
CNCc1cc(ccc1Oc1ccc(Cl)c(Cl)c1)C(=O)N1CCCN(CC1)C(C)C
CNCc1cc(ccc1Oc1ccc(Cl)cc1)C(=O)N1CCCN(CC1)C1CC1
CNCc1cc(ccc1Oc1ccc(SC)c(C)c1)C(=O)N1CCCN(CC1)C1CC1
CNCc1cc(ccc1Oc1ccc(SC)cc1)C(=O)N1CCCN(CC1)C1CC1
CNCc1cc(ccc1Oc1ccccc1C#N)C(=O)N1CCCN(CC1)C1CC1
CNCc1cc(ccc1Oc1ccc(Cl)cc1F)C(=O)N1CCCN(CC1)C1CC1
CNCc1cc(ccc1Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCCN(CC1)C1CC1
CNCc1cc(ccc1Oc1ccccc1C(F)(F)F)C(=O)N1CCCN(CC1)C1CC1
CNCc1cc(ccc1Oc1ccc(F)cc1)C(=O)N1CCCN(CC1)C1CC1
CNCc1cc(ccc1Oc1ccccc1F)C(=O)N1CCCN(CC1)C1CC1
CNCc1cc(ccc1Oc1ccccc1)C(=O)N1CCCN(CC1)C1CC1
CNCc1cc(ccc1Oc1cccc(OC)c1)C(=O)N1CCCN(CC1)C1CC1
C(Cc1ccccn1)N1CCCC1
C[C@H]1CCCN1CCc1ccc(OCc2ccccc2)cc1
C(Cc1ccc(OCc2ccccc2)cc1)N1CCCC1
C[C@@H]1CCCN1CCc1ccc2ccccc2c1
C(Cc1ccc2ccccc2c1)N1CCCC1
C[C@@H]1CCCN1CCc1nc(oc1C)-c1ccccc1
C[C@@H]1CCCN1CCc1ccc(OCc2ccccc2)cc1
C[C@H]1CCCN1CCc1ccc2ccccc2c1
C[C@H]1CCCN1CCc1cccnc1
C[C@H]1CCCN1CCc1nc(oc1C)-c1ccccc1
COc1ccc2[nH]c(CCN3CCC[C@@H]3C)cc2c1
C(Cc1cc2ccccc2[nH]1)N1CCCC1
COc1ccc(CCN2CCCC2)cc1
COc1ccccc1CCN1CCC[C@H]1C
C[C@@H]1CCCN1CCc1ccc(C)cc1
C[C@@H]1CCCN1CCc1cccc(C)c1
C[C@H]1CCCN1CCc1c(C)cc(C)cc1C
C[C@H]1CCCN1CCc1ccccc1O
[O-][N+](=O)c1ccc(CCN2CCCC2)cc1
CN(C)c1ccc(CCN2CCCC2)cc1
C(Cc1cccs1)N1CCCC1
CCc1ccc(CCN2CCC[C@H]2C)nc1
C[C@@H]1CCCN1CCc1ccncc1
C[C@H]1CCCN1CCc1ccccn1
C[C@H]1CCCN1CCc1ccc(C)cc1
Cc1ccc(CCN2CCCC2)cc1
C[C@H]1CCCN1CCc1cccc(C)c1
Cc1cccc(CCN2CCCC2)c1
Cc1oc(nc1CCN1CCCC1)-c1ccccc1
COc1ccc2[nH]c(CCN3CCC[C@H]3C)cc2c1
COc1ccc2[nH]c(CCN3CCCC3)cc2c1
C[C@@H]1CCCN1CCc1cc2ccccc2[nH]1
C[C@H]1CCCN1CCc1cc2ccccc2[nH]1
COc1ccc(CCN2CCC[C@H]2C)cc1
COc1ccc(CCN2CCC[C@@H]2C)cc1
COc1cccc(CCN2CCC[C@H]2C)c1
COc1cccc(CCN2CCC[C@@H]2C)c1
COc1cccc(CCN2CCCC2)c1
COc1ccccc1CCN1CCC[C@@H]1C
COc1ccccc1CCN1CCCC1
C[C@@H]1CCCN1CCc1c(C)cc(C)cc1C
Cc1cc(C)c(CCN2CCCC2)c(C)c1
C[C@@H]1CCCN1CCc1ccccc1O
Oc1ccccc1CCN1CCCC1
C[C@@H]1CCCN1CCc1ccc(cc1)[N+]([O-])=O
C[C@H]1CCCN1CCc1ccc(cc1)[N+]([O-])=O
C[C@@H]1CCCN1CCc1ccc(cc1)N(C)C
C[C@H]1CCCN1CCc1ccc(cc1)N(C)C
C[C@@H]1CCCN1CCc1cccs1
C[C@H]1CCCN1CCc1cccs1
C[C@@H]1CCCN1CCc1ccns1
C[C@H]1CCCN1CCc1ccns1
C(Cc1ccns1)N1CCCC1
CCc1ccc(CCN2CCC[C@@H]2C)nc1
CCc1ccc(CCN2CCCC2)nc1
C[C@H]1CCCN1CCc1ccncc1
C(Cc1ccncc1)N1CCCC1
C[C@@H]1CCCN1CCc1cccnc1
C(Cc1cccnc1)N1CCCC1
C[C@@H]1CCCN1CCc1ccccn1
C(Cc1ccc(cc1)C1=CCC2CN(Cc3ccccc3)CC12)N1Cc2ccccc2C1 |w:22.23,11.12,t:9|
O=C1CCCN1CCc1ccc(cc1)C1=CCC2CN(Cc3ccccc3)CC12 |w:17.18,28.30,t:16|
FC1(F)CCN(CCc2ccc(cc2)C2=CCC3CN(Cc4ccccc4)CC23)C1 |w:17.17,28.29,t:15|
C(Cc1ccc(cc1)C1=CCC2CN(Cc3ccccc3)CC12)N1CCCC1 |w:11.12,22.23,t:9|
CN1CCN(CCc2ccc(cc2)C2=CCC3CN(Cc4ccccc4)CC23)CC1 |w:16.16,27.28,t:14|
C(Cc1ccc(cc1)C1=CCC2CN(Cc3ccccc3)CC12)N1CCOCC1 |w:11.11,22.23,t:9|
C(Cc1ccc(cc1)C1=CCC2CN(Cc3ccccc3)CC12)N1CCCCC1 |w:11.11,22.23,t:9|
C(Cc1ccc(cc1)C1=CCC2CN(Cc3ccccc3)CC12)N1CCC1 |w:11.12,22.23,t:9|
C(Cc1ccc(cc1)C1=CC[C@H]2CN(Cc3ccccc3)C[C@@H]12)N1CCCC1 |t:9|
C(Cc1ccc(cc1)C1=CCC2CN(CC12)C1CCCC1)N1CCCC1 |w:11.12,15.15,t:9|
OC[C@@H]1CCCN1CCc1ccc(cc1)C1=CCC2CN(Cc3ccccc3)CC12 |w:18.19,29.31,t:17|
OC[C@H]1CCCN1CCc1ccc(cc1)C1=CCC2CN(Cc3ccccc3)CC12 |w:18.19,29.31,t:17|
CC1CCCN1CCc1ccc(cc1)C1=CCC2CN(Cc3ccccc3)CC12 |w:17.18,28.30,1.0,t:16|
C(Cc1ccc(cc1)C1=CCC2CN(CC12)c1ccccn1)N1CCCC1 |w:11.12,15.15,t:9|
C(Cc1ccc(cc1)C1=CCC2CN(CC12)c1ccccc1)N1CCCC1 |w:11.12,15.15,t:9|
CC(C)N1CC2CC=C(C2C1)c1ccc(CCN2CCCC2)cc1 |w:5.4,9.10,c:7|
CN(C)CCc1ccc(cc1)C1=CCC2CN(Cc3ccccc3)CC12 |w:14.15,25.26,t:12|
CC(C)N1C[C@@H]2CC=C([C@@H]2C1)c1ccc(CCN2CCCC2)cc1 |c:7|
C(Cc1ccc(cc1)C1=CC[C@H]2CN(C[C@@H]12)C1CCCC1)N1CCCC1 |t:9|
C(Cc1ccc(cc1)C1=CC[C@@H]2CN(Cc3ccccc3)C[C@H]12)N1CCCC1 |t:9|
C(Cc1ccc(cc1)C1=CCC2CN(CC12)c1cncnc1)N1CCCC1 |w:11.12,15.15,t:9|
C(Cc1ccc(cc1)C1=CCC2CN(CC12)c1ncccn1)N1CCCC1 |w:11.12,15.15,t:9|
COc1cc2c(cc1OC)C(=O)[C@@H](C2)CC3CCN(CC3)Cc4ccccc4
C[N+](C)(C)CCCCCCCCCC[N+](C)(C)C
OCCC1CCN(Cc2ccc(OCCCN3CCCCC3)cc2)CC1
COc1ccccc1CNCCc1cc(OC)c(I)cc1OC
CC(C)N1CCC(CC1)Oc1ccc2cc(ccc2c1)C(=O)NC1CCCCC1
CC(C)N1CCC(CC1)Oc1ccc2cc(ccc2c1)C(=O)N1CCCC1
O=C(N1CCCC1)c1ccc2cc(OCCCN3CCCCC3)ccc2c1
CC(CC(=O)NC(N)=NCCCc1cnc[nH]1)c1cccs1 |w:8.8|
COc1cccc(OCCOCCCN2CCCC(C)C2)c1
COc1cccc(OCCOCCCN2CCC(C)CC2)c1
COc1cccc(OCCOCCCN2CCCCCC2)c1
CC1CCCN(CCCOCCOc2ccc(cc2)C(C)(C)C)C1
COc1cccc(OCCCOCCCN2CCCC(C)C2)c1
COc1cccc(OCCCOCCCN2CCC(C)CC2)c1
COc1cccc(OCCCOCCCN2CCCCCC2)c1
CC1CCCN(CCCOCCCOc2ccc(Cl)cc2)C1
CC1CCN(CCCOCCCOc2ccc(Cl)cc2)CC1
CC1CCCCN(CCCOCCCOc2ccc(Cl)cc2)C1
CC1CCCN(CCCOCCCOc2ccc(cc2)C(C)(C)C)C1
CC1CCN(CCCOCCCOc2ccc(cc2)C(C)(C)C)CC1
CC(C)(C)c1ccc(OCCCOCCCN2CCCCCC2)cc1
[#6]-[#7](-[#6])-[#6]-[#6]\[#6]=[#6]-1/c2ccccc2-[#6]-[#6]-c2ccccc-12
[#6]-[#7](-[#6]-[#6]\[#6]=[#6]-1/c2ccccc2-[#6]-[#6]-c2ccccc-12)-[#6](=O)-[#6]-c1ccc(-[#8]-[#6]-[#6]-[#6]-[#7]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)cc1
[#6]-[#7](-[#6]-[#6]\[#6]=[#6]-1/c2ccccc2-[#6]-[#6]-c2ccccc-12)-[#6](=O)-c1ccc(-[#8]-[#6]-[#6]-[#6]-[#7]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)cc1
[#6]-[#7](-[#6]-[#6]\[#6]=[#6]-1/c2ccccc2-[#6]-[#6]-c2ccccc-12)-[#6]-c1ccc(-[#8]-[#6]-[#6]-[#6]-[#7]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)cc1
CN(CCCC12CCC(c3ccccc13)c1ccccc21)Cc1ccc(OCCCN2CCCCC2)cc1
CN(C)CCCN1c2ccccc2Sc3c1cc(cc3)Cl
CN(CCCN1c2ccccc2Sc2ccc(Cl)cc12)Cc1ccc(OCCCN2CCCCC2)cc1
CN(C)CC\C=C1\c2ccccc2Sc2ccc(Cl)cc12
CN(CC\C=C1/c2ccccc2Sc2ccc(Cl)cc12)Cc1ccc(OCCCN2CCCCC2)cc1
Clc1ccc2Nc3ccccc3C(=Nc2c1)N1CCN(Cc2ccc(OCCCN3CCCCC3)cc2)CC1 |c:13|
OCCN1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1
FC(F)(F)c1ccc2Sc3ccccc3N(CCCN3CCN(CCOC(=O)c4ccc(OCCCN5CCCCC5)cc4)CC3)c2c1
FC(F)(F)Cn1c(cc2cc(ccc12)C(=O)N1CCN(CC1)C1CCC1)C(=O)N1CCOCC1
O=C(N1CCOCC1)c1cc2cc(OCCCN3CCCCC3)ccc2[nH]1
O=C(N1CCOCC1)c1cc2cc(OC3CCN(CC3)C3CC3)ccc2[nH]1
CC(C)(C)N1CCC(CC1)Oc1ccc2[nH]c(cc2c1)C(=O)N1CCOCC1
COC1CCN(CC1)C(=O)c1cc2cc(OC3CCN(CC3)C(C)C)ccc2[nH]1
CC(C)N1CCC(CC1)Oc1ccc2[nH]c(cc2c1)C(=O)N1CCC(O)C1
CC(C)N1CCC(CC1)Oc1ccc2[nH]c(cc2c1)C(=O)N1CCCC(F)(F)C1
CC(C)N1CCC(CC1)Oc1ccc2[nH]c(cc2c1)C(=O)N1CCC(F)(F)CC1
CC(C)N1CCC(CC1)Oc1ccc2[nH]c(cc2c1)C(=O)N1CCS(=O)(=O)CC1
CC(C)N1CCC(CC1)Oc1ccc2cc([nH]c2c1)C(=O)N1CCOCC1
CC(C)N1CCC(CC1)Oc1ccc2n(CC(F)(F)F)c(cc2c1)C(=O)N1CCOCC1
CC(C)N1CCC(CC1)Oc1ccc2n(CC(F)(F)F)c(cc2c1)C(=O)N1CCC(F)(F)CC1
CC(C)N1CCC(CC1)Oc1ccc2n(C(C)=O)c(cc2c1)C(=O)N1CCC(F)(F)CC1
CC(C)N1CCC(CC1)Oc1ccc2n(c(cc2c1)C(=O)N1CCC(F)(F)CC1)S(C)(=O)=O
CC(C)N1CCC(CC1)Oc1ccc2n(c(cc2c1)C(=O)N1CCC(F)(F)CC1)S(=O)(=O)c1ccc(F)cc1
CC(C)N1CCC(CC1)Oc1ccc2n(CC#N)c(cc2c1)C(=O)N1CCC(F)(F)CC1
CC(C)N1CCC(CC1)Oc1ccc2n(c(cc2c1)C(=O)N1CCC(F)(F)CC1)-c1ccc(Cl)c(Cl)c1
CC(C)N1CCC(CC1)Oc1ccc2n(CC(F)(F)F)c(cc2c1)C(=O)N1CCS(=O)(=O)CC1
FC(F)(F)Cn1c(cc2cc(OC3CCN(CC3)C3CCC3)ccc12)C(=O)N1CCOCC1
FC(F)(F)Cn1c(cc2cc(OC3CCN(CC3)C3COC3)ccc12)C(=O)N1CCOCC1
FC(F)(F)Cn1c(cc2cc(OC3CCN(CC3)C3CC3)ccc12)C(=O)N1CCOCC1
CC(C)N1CCC(CC1)Nc1ccc2[nH]c(cc2c1)C(=O)N1CCOCC1
CCOC(=O)c1cc2cc(ccc2[nH]1)C(O)=O
CC(C)N1CCC(CC1)Oc1ccc2[nH]c(C)c(C(=O)N3CCOCC3)c2c1
CC(C)N1CCC(CC1)Oc1cc2[nH]c(cc2cc1F)C(=O)N1CCOCC1
CN(C)[C@@H]1CCN(CCCOc2c(F)cc(cc2F)-c2ccc(cc2)C#N)C1 |r|
CC(C)N1CCC(CC1)Oc1ccc2[nH]c(cc2c1)C(=O)N1CCOCC1
CC(C)N1CCC(CC1)Oc1ccc2[nH]c(cc2c1)C(=O)N1CCCCCC1
CNCCc1ccccn1
COc1cc2CCN(C)[C@H]3Cc4cc5OCOc5cc4-c(c1OC)c23
CN[C@@H]1CCN(C1)c1nc(N)nc2c3cc(Cl)ccc3oc12 |r|
Fc1ccc(Oc2ccnc(c2)C(=O)N2CCCN(CC2)C2CCC2)cc1
O=C(N1CCCN(CC1)C1CCC1)c1cc(Oc2ccccc2)ccn1
Fc1ccc(Oc2cncc(c2)C(=O)N2CCCN(CC2)C2CCC2)cc1
O=C(N1CCCN(CC1)C1CCC1)c1cncc(Oc2ccccc2)c1
Clc1ccc(Oc2cccc(n2)C(=O)N2CCCN(CC2)C2CCC2)cc1Cl
Clc1ccc(Oc2cccc(n2)C(=O)N2CCCN(CC2)C2CC2)cc1Cl
CC(C)N1CCCN(CC1)C(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1
Fc1ccc(Sc2ccc(cn2)C(=O)N2CCCN(CC2)C2CCC2)cc1
O=C(N1CCCN(CC1)C1CCC1)c1ccc(Sc2ccccc2)nc1
Fc1ccc(Sc2ccc(nc2)C(=O)N2CCCN(CC2)C2CCC2)cc1
O=C(N1CCCN(CC1)C1CCC1)c1ccc(Sc2ccccc2)cn1
Fc1ccccc1Oc1ccc(nc1)C(=O)N1CCCN(CC1)C1CCC1
Fc1cccc(Oc2ccc(nc2)C(=O)N2CCCN(CC2)C2CCC2)c1
Fc1ccc(Oc2ccc(nc2)C(=O)N2CCCN(CC2)C2CCC2)cc1
Clc1cccc(Oc2ccc(nc2)C(=O)N2CCCN(CC2)C2CCC2)c1
Clc1ccc(Oc2ccc(nc2)C(=O)N2CCCN(CC2)C2CCC2)cc1
Clc1ccc(Oc2ccc(nc2)C(=O)N2CCCN(CC2)C2CC2)cc1Cl
CC(C)N1CCCN(CC1)C(=O)c1ccc(Oc2ccc(Cl)c(Cl)c2)cn1
Clc1ccccc1Oc1ccc(cn1)C(=O)N1CCCN(CC1)C1CCC1
Clc1ccc(Oc2ccc(cn2)C(=O)N2CCCN(CC2)C2CCC2)cc1
Clc1ccc(Oc2ccc(cn2)C(=O)N2CCCN(CC2)C2CC2)cc1
Clc1cccc(Oc2ccc(cn2)C(=O)N2CCCN(CC2)C2CCC2)c1
Clc1cccc(Oc2ccc(cn2)C(=O)N2CCCN(CC2)C2CC2)c1
Clc1ccc(Oc2ccc(cn2)C(=O)N2CCCN(CC2)C2CCC2)cc1Cl
CC(C)N1CCCN(CC1)C(=O)c1ccc(Oc2ccc(Cl)c(Cl)c2)nc1
O=C(N1CCCN(CC1)C1CCC1)c1ccc(Oc2ccccc2)nc1
O=C(N1CCCN(CC1)C1CC1)c1ccc(Oc2ccccc2)nc1
O=C(N1CCCN(CC1)C1CCC1)c1ccc(Oc2cccc(c2)C#N)nc1
O=C(N1CCCN(CC1)C1CC1)c1ccc(Oc2cccc(c2)C#N)nc1
Fc1ccc(Oc2ccc(cn2)C(=O)N2CCCN(CC2)C2CCC2)cc1
Fc1cccc(Oc2ccc(cn2)C(=O)N2CCCN(CC2)C2CCC2)c1
Fc1cccc(Oc2ccc(cn2)C(=O)N2CCCN(CC2)C2CC2)c1
Fc1ccc(Oc2ccc(cn2)C(=O)N2CCCN(CC2)C2CC2)cc1
CCN1CCCN(CC1)C(=O)c1ccc(Oc2ccc(F)cc2)nc1
CN1CCCN(CC1)C(=O)c1ccc(Oc2ccc(F)cc2)nc1
Fc1ccc(Oc2ccc(cn2)C(=O)N2CCCNCC2)cc1
Clc1ccccc1Oc1ccc(cn1)C(=O)N1CCN(CC1)C1CCCC1
CC(C)N1CCN(CC1)C(=O)c1ccc(Oc2ccccc2Cl)nc1
CC(C)N1CCN(CC1)C(=O)c1ccc(Oc2cccc(Cl)c2)nc1
CC(C)N1CCN(CC1)C(=O)c1ccc(Oc2ccc(Cl)cc2)nc1
Fc1ccc(Oc2ccc(cn2)C(=O)N2CCN(CC2)C2CC2)cc1
CC(C)N1CCN(CC1)C(=O)c1ccc(Oc2ccc(F)cc2)nc1
CC(C)N1CCN(CC1)C(=O)c1ccc(Oc2cccc(c2)C#N)nc1
CC(C)N1CCN(CC1)C(=O)c1ccc(Oc2ccccc2)nc1
CSc1ccc(Oc2ccc(cn2)C(=O)N2CCN(CC2)C(C)C)cc1
CC(C)N1CCN(CC1)C(=O)c1ccc(Oc2ccc(Cl)c(Cl)c2)nc1
CN(C)c1ccc(cc1)N1CCC(Cc2cnc[nH]2)CC1
C(C1CCN(CC1)c1ccc2ccccc2c1)c1cnc[nH]1
C(C1CCN(CC1)c1cccnc1)c1cnc[nH]1
C(N1CCN(CC1)c1ccccc1)c1cnc[nH]1
FC(F)(F)c1ccc(cc1)N1CCN(Cc2cnc[nH]2)CC1
CC(C)(C)c1ccc(cc1)N1CCN(Cc2cnc[nH]2)CC1
C(C1CCN(CC1)c1ccccc1)c1cnc[nH]1
Fc1ccc(cc1)N1CCC(Cc2cnc[nH]2)CC1
[O-][N+](=O)c1ccc(cc1)N1CCC(Cc2cnc[nH]2)CC1
FC(F)(F)c1ccc(cc1)N1CCC(Cc2cnc[nH]2)CC1
FC(F)(F)c1cccc(c1)N1CCC(Cc2cnc[nH]2)CC1
CC(C)c1ccc(cc1)N1CCC(Cc2cnc[nH]2)CC1
CC(C)c1cccc(c1)N1CCC(Cc2cnc[nH]2)CC1
COc1ccc(cc1)N1CCC(Cc2cnc[nH]2)CC1
CC(C)(C)c1ccc(cc1)N1CCC(Cc2cnc[nH]2)CC1
CNc1ccc(cc1)N1CCC(Cc2cnc[nH]2)CC1
C(C1CCN(CC1)c1ccc(cc1)-c1ccccc1)c1cnc[nH]1
Fc1nc(cs1)C#Cc1cc(F)cc(c1)C#N
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1ccc(=O)n(C)n1 |r|
C[C@H]1CCCN1CCCOc1ccc(cc1)-c1ccc(=O)[nH]n1 |r|
O=c1ccc(n[nH]1)-c1ccc(OCCCN2CCCC2)cc1
O=c1ccc(n[nH]1)-c1ccc(OCCCN2CCCCC2)cc1
O=c1ccc(n[nH]1)-c1ccc(OCCCN2CCOCC2)cc1
CCn1nc(ccc1=O)-c1ccc(OCCCN2CCC[C@H]2C)cc1 |r|
CC(C)n1nc(ccc1=O)-c1ccc(OCCCN2CCC[C@H]2C)cc1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1ccc(=O)n(n1)-c1ccccc1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1ccc(=O)n(Cc2ccccc2)n1 |r|
Cn1nc(ccc1=O)-c1ccc(OCCCN2CCCCC2)cc1
Cn1nc(ccc1=O)-c1ccc(OCCCN2CCC[C@H]2CO)cc1 |r|
Cn1nc(ccc1=O)-c1ccc(OCCCN2CCC[C@@H]2CO)cc1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-n1ncccc1=O |r|
Cn1nc(ccc1=O)-c1ccc(cc1)N1CCN(CC1)C1CCCC1
CC(C)N1CCN(CC1)c1ccc(cc1)-c1ccc(=O)n(C)n1
Cn1nc(ccc1=O)-c1ccc(cc1)N1CCN2CCC[C@H]2C1 |r|
Cn1nc(ccc1=O)-c1ccc(cc1)C(=O)N1CCN(CC1)C1CCCC1
CC(C)N1CCN(CC1)C(=O)c1ccc(cc1)-c1ccc(=O)n(C)n1
Cn1nc(ccc1=O)-c1ccc(cc1)C(=O)N1CCC[C@H]1CN1CCCC1 |r|
Fc1ccc(cc1)-n1nc(ccc1=O)-c1ccc(cc1)C(=O)N1CCC[C@H]1CN1CCCC1 |r|
O=C(N1CCC[C@H]1CN1CCCC1)c1ccc(cc1)-c1ccc(=O)[nH]n1 |r|
CN1CCCN(CC1)c1ccc(cc1)-c1ccc(=O)n(C)n1
Cn1nc(ccc1=O)-c1ccc(cc1)C(=O)N1CCN2CCC[C@H]2C1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1n[nH]c(=O)cc1-c1ccccn1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1F)-c1ccc(=O)n(C)n1 |r|
C[C@@H]1CCCN1CCCOc1c(F)cc(cc1F)-c1ccc(=O)[nH]n1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1ccc(=O)n(n1)-c1ccccn1 |r|
C[C@@H]1CCCN1CCCOc1ccc(c(F)c1)-c1ccc(=O)[nH]n1 |r|
C[C@@H](COc1ccc(cc1)-c1ccc(=O)n(C)n1)CN1CCC[C@H]1C |r|
C[C@@H]1CCCN1CCCOc1c(F)cc(cc1F)-c1ccc(=O)n(C)n1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1C#N)-c1ccc(=O)[nH]n1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cn1)-c1ccc(=O)[nH]n1 |r|
COc1cc(OCCCN2CCC[C@H]2C)ccc1-c1ccc(=O)[nH]n1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1ccc(=O)n(CCF)n1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1ccc(=O)n(CC(F)(F)F)n1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1ccc(=O)n(CCO)n1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1ccc(=O)n(n1)-c1ncccn1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1cc(C)c(=O)[nH]n1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1cc(-c2ccccn2)c(=O)[nH]n1 |r|
C[C@H](COc1ccc(cc1)-c1ccc(=O)n(C)n1)CN1CCC[C@H]1C |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1Cl)-c1ccc(=O)n(C)n1 |r|
Cn1nc(-c2ccc(OCCCN3CCCCC3)cc2)c2CCCCc2c1=O
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1nn(C)c(=O)c2CCCCc12 |r|
CN1N=C(C2CCCC2C1=O)c1ccc(OCCCN2CCCCC2)cc1 |c:2|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C1=NN(C)C(=O)C2CCCC12 |r,t:18|
Cn1nc(c2CCCc2c1=O)-c1ccc(OCCCN2CCCCC2)cc1
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1nn(C)c(=O)c2CCCc12 |r|
Clc1ccc(Cn2nc(-c3ccc(OCCCN4CCCCC4)cc3)c3sccc3c2=O)cc1
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1nn(Cc2ccc(Cl)cc2)c(=O)c2ccsc12 |r|
CCCn1nc(-c2ccc(OCCCN3CCC(C)CC3)cc2)c2sccc2c1=O
CCCn1nc(-c2ccc(OCCCN3CCC[C@H]3C)cc2)c2sccc2c1=O |r|
CC(C)n1nc(-c2ccc(OCCCN3CCCC3)cc2)c2sccc2c1=O
CCN(CC)CCCOc1ccc(cc1)-c1nn(C(C)C)c(=O)c2ccsc12
COC[C@H]1CCCN1CCCOc1ccc(cc1)-c1nn(C(C)C)c(=O)c2ccsc12 |r|
COC[C@@H]1CCCN1CCCOc1ccc(cc1)-c1nn(C(C)C)c(=O)c2ccsc12 |r|
CC(C)n1nc(-c2ccc(OCCCN3CCCCC3)cc2)c2sccc2c1=O
CC(C)n1nc(-c2ccc(OCCCN3CCC[C@H]3C)cc2)c2sccc2c1=O |r|
Clc1ccc(Cn2nc(-c3ccc(OCCCN4CCCCC4)cc3)c3ccccc3c2=O)cc1
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1nn(Cc2ccc(Cl)cc2)c(=O)c2ccccc12 |r|
Cn1nc(-c2ccc(OCCCN3CCCCCC3)cc2)c2ccccc2c1=O
Cn1nc(-c2ccc(OCCCN3CCCC3)cc2)c2ccccc2c1=O
Cn1nc(-c2ccc(OCCCN3CCCCC3)cc2)c2ccccc2c1=O
Cn1nc(-c2ccc(OCCN3CCCCC3)cc2)c2ccccc2c1=O
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1nn(C)c(=O)c2ccccc12 |r|
C[C@@H](NCc1ccc(OCc2ccc(OCCCN3CCCCC3)cc2)cc1)C(N)=O |r|
C(CCCN1CCCCCC1)CCOc1ccc2ccccc2c1
CC1CCN(CCCCCCOc2ccc3ccccc3c2)CC1
CC1CCN(CCCCCOc2ccc3ccccc3c2)CC1
C(CCCN1CCCCCC1)CCOc1cccc2ccccc12
CC1CCCN(CCCCCCOc2cccc3ccccc23)C1
C(CCCN1CCCCC1)CCOc1cccc2ccccc12
CC1CCN(CCCCCCOc2cccc3ccccc23)CC1
C(CCOc1cccc2ccccc12)CCN1CCCCCC1
CC1CCCN(CCCCCOc2cccc3ccccc23)C1
C(CCOc1cccc2ccccc12)CCN1CCCCC1
CC1CCN(CCCCCOc2cccc3ccccc23)CC1
CC1CCCN(CCCCCCOc2ccc3ccccc3c2)C1
C(CCCN1CCCCC1)CCOc1ccc2ccccc2c1
C(CCOc1ccc2ccccc2c1)CCN1CCCCCC1
CC1CCCN(CCCCCOc2ccc3ccccc3c2)C1
C(CCOc1ccc2ccccc2c1)CCN1CCCCC1
C[C@H](NCc1ccc(OCc2ccc(OCCCN3CCCCC3)cc2)cc1)C(N)=O |r|
CS(=O)(=O)N1CCC(CC1)Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1
Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1
CC(C)(C)OC(=O)N1CCC(CC1)Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1
C1CC(C1)N1CCC2(CC1)CCc1cc(OC3CCNCC3)ccc1O2
CCS(=O)(=O)N1CCC(CC1)Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1
CC(C)S(=O)(=O)N1CCC(CC1)Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1
O=S(=O)(C1CC1)N1CCC(CC1)Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1
CC(=O)N1CCC(CC1)Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1
CC(C)C(=O)N1CCC(CC1)Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1
O=C(C1CC1)N1CCC(CC1)Oc1ccc2OC3(CCN(CC3)C3CCC3)CCc2c1
CC(C)NC(=O)NS(=O)(=O)c1ccc(OCCN2CCCC2)cc1
Clc1ccc(Cl)c(NC(=O)NS(=O)(=O)c2ccc(OCCCCN3CCCCC3)cc2)c1
FC(F)(F)c1ccc(NC(=O)NS(=O)(=O)c2ccc(OCCCCN3CCCCC3)cc2)cc1
CCOC(=O)C1CCN(CCCCOc2ccc(cc2)S(=O)(=O)NC(=O)Nc2ccccc2)CC1
FC(F)(F)c1cccc(NC(=O)NS(=O)(=O)c2ccc(OCCCN3CCCC3)cc2)c1
CC(=O)c1ccc(NC(=O)NS(=O)(=O)c2ccc(OCCCN3CCCC3)cc2)cc1
Cc1ccc(NC(=O)NS(=O)(=O)c2ccc(OCCCN3CCCC3)cc2)cc1
O=C(Nc1cccc2ccccc12)NS(=O)(=O)c1ccc(OCCCN2CCCC2)cc1
CN(C)c1ccc(NC(=O)NS(=O)(=O)c2ccc(OCCCN3CCCC3)cc2)cc1
O=C(NC(c1ccccc1)c1ccccc1)NS(=O)(=O)c1ccc(OCCCN2CCCC2)cc1
FC(F)(F)c1ccccc1NC(=O)NS(=O)(=O)c1ccc(OCCCN2CCCCC2)cc1
FC(F)(F)c1cccc(NC(=O)NS(=O)(=O)c2ccc(OCCCN3CCCCC3)cc2)c1
COc1ccc(NC(=O)NS(=O)(=O)c2ccc(OCCCN3CCCCC3)cc2)cc1
CC(=O)c1ccc(NC(=O)NS(=O)(=O)c2ccc(OCCCN3CCCCC3)cc2)cc1
Cc1ccc(NC(=O)NS(=O)(=O)c2ccc(OCCCN3CCCCC3)cc2)cc1
O=C(NC(c1ccccc1)c1ccccc1)NS(=O)(=O)c1ccc(OCCCN2CCCCC2)cc1
O=C(Nc1ccccc1)NS(=O)(=O)c1ccc(OCCCN2CCCC2)cc1
O=C(NC1CCCCC1)NS(=O)(=O)c1ccc(OCCCN2CCCC2)cc1
Clc1ccc(Cl)c(NC(=O)NS(=O)(=O)c2ccc(OCCCN3CCCC3)cc2)c1
FC(F)(F)c1ccc(NC(=O)NS(=O)(=O)c2ccc(OCCCN3CCCC3)cc2)cc1
CC(C)NC(=O)NS(=O)(=O)c1ccc(OCCCN2CCCCC2)cc1
O=C(Nc1ccccc1)NS(=O)(=O)c1ccc(OCCCN2CCCCC2)cc1
Clc1ccc(Cl)c(NC(=O)NS(=O)(=O)c2ccc(OCCCN3CCCCC3)cc2)c1
FC(F)(F)c1ccc(NC(=O)NS(=O)(=O)c2ccc(OCCCN3CCCCC3)cc2)cc1
CCOC(=O)C1CCN(CCCOc2ccc(cc2)S(=O)(=O)NC(=O)Nc2ccccc2)CC1
CC(C)NC(=O)NS(=O)(=O)c1ccc(OCCCCN2CCCC2)cc1
O=C(Nc1ccccc1)NS(=O)(=O)c1ccc(OCCCCN2CCCC2)cc1
O=C(NC1CCCCC1)NS(=O)(=O)c1ccc(OCCCCN2CCCC2)cc1
Clc1ccc(Cl)c(NC(=O)NS(=O)(=O)c2ccc(OCCCCN3CCCC3)cc2)c1
FC(F)(F)c1ccc(NC(=O)NS(=O)(=O)c2ccc(OCCCCN3CCCC3)cc2)cc1
CC(C)NC(=O)NS(=O)(=O)c1ccc(OCCCCN2CCCCC2)cc1
O=C(Nc1ccccc1)NS(=O)(=O)c1ccc(OCCCCN2CCCCC2)cc1
O=C(NC1CCCCC1)NS(=O)(=O)c1ccc(OCCCCN2CCCCC2)cc1
NS(=O)(=O)c1ccc(OCCN2CCCCC2)cc1
NS(=O)(=O)c1ccc(OCCCN2CCCC2)cc1
NS(=O)(=O)c1ccc(OCCCN2CCCCC2)cc1
CCOC(=O)C1CCN(CCCOc2ccc(cc2)S(N)(=O)=O)CC1
NS(=O)(=O)c1ccc(OCCCN2CCOCC2)cc1
NS(=O)(=O)c1ccc(OCCCCN2CCCC2)cc1
NS(=O)(=O)c1ccc(OCCN2CCCC2)cc1
NS(=O)(=O)c1ccc(OCCCCN2CCCCC2)cc1
CCOC(=O)C1CCN(CCCCOc2ccc(cc2)S(N)(=O)=O)CC1
O=C(Nc1ccccc1)NS(=O)(=O)c1ccc(OCCN2CCCC2)cc1
O=C(NC1CCCCC1)NS(=O)(=O)c1ccc(OCCN2CCCC2)cc1
Clc1ccc(Cl)c(NC(=O)NS(=O)(=O)c2ccc(OCCN3CCCC3)cc2)c1
CC(C)NC(=O)NS(=O)(=O)c1ccc(OCCN2CCCCC2)cc1
O=C(Nc1ccccc1)NS(=O)(=O)c1ccc(OCCN2CCCCC2)cc1
O=C(NC1CCCCC1)NS(=O)(=O)c1ccc(OCCN2CCCCC2)cc1
Clc1ccc(Cl)c(NC(=O)NS(=O)(=O)c2ccc(OCCN3CCCCC3)cc2)c1
FC(F)(F)c1ccc(NC(=O)NS(=O)(=O)c2ccc(OCCN3CCCCC3)cc2)cc1
CCOC(=O)C1CCN(CCOc2ccc(cc2)S(=O)(=O)NC(=O)Nc2ccccc2)CC1
CC(C)NC(=O)NS(=O)(=O)c1ccc(OCCCN2CCCC2)cc1
FC(F)(F)c1ccc(NC(=O)NS(=O)(=O)c2ccc(OCCN3CCCC3)cc2)cc1
CCOC(=O)C1CCN(CCOc2ccc(cc2)S(N)(=O)=O)CC1
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C(=O)c1ccc(F)cc1 |r|
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C(=O)c1ccc(cc1)[N+]([O-])=O |r|
O=C1N(CCN2CCCC2)CCc2cc(ccc12)-c1ccccc1
Fc1ccccc1-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
Fc1cccc(c1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
Fc1ccc(cc1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
O=C1N(CCN2CCCC2)CCc2cc(ccc12)-c1cccc(c1)C#N
O=C1N(CCN2CCCC2)CCc2cc(ccc12)-c1ccc(cc1)C#N
FC(F)(F)c1cccc(c1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
FC(F)(F)c1ccc(cc1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
FC(F)(F)Oc1cccc(c1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
FC(F)(F)Oc1ccc(cc1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
Fc1ccc(c(F)c1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
Fc1ccc(cc1F)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
Fc1cc(F)cc(c1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
O=C1N(CCCN2CCCC2)CCc2cc(ccc12)-c1ccc(cc1)C#N
Fc1ccc(cc1)-c1ccc2C(=O)N(CCN3CCCCC3)CCc2c1
Fc1ccc(cc1)-c1ccc2C(=O)N(CCN3CCCCCC3)CCc2c1
C[C@H]1CCCN1CCN1CCc2cc(ccc2C1=O)-c1ccc(F)cc1 |r|
C[C@@H]1CCCN1CCN1CCc2cc(ccc2C1=O)-c1ccc(F)cc1 |r|
C[C@H]1CCCN1CCN1CCc2cc(ccc2C1=O)-c1ccc(cc1)C#N |r|
C[C@@H]1CCCN1CCN1CCc2cc(ccc2C1=O)-c1ccc(cc1)C#N |r|
C[C@@H]1CCCN1CCN1CCc2c(cccc2-c2ccc(cc2)C#N)C1=O |r|
C[C@@H]1CCCN1CCN1CCc2ccc(cc2C1=O)-c1ccc(cc1)C#N |r|
C[C@@H]1CCCN1CCN1Cc2c(cccc2-c2ccc(cc2)C#N)C1=O |r|
C[C@@H]1CCCN1CCN1CCc2cc(Oc3ccc(cc3)C#N)ccc2C1=O |r|
C[C@@H]1CCCN1CCN1CCc2cc(Oc3ccc(cn3)C#N)ccc2C1=O |r|
C[C@@H]1CCCN1CCN1CCc2cc(Oc3ccc(nc3)C#N)ccc2C1=O |r|
O=C1N(CCN2CCCC2)CCc2cc(ccc12)-c1ccncc1
O=C(C1CC1)c1ccc(cc1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
NC(=O)c1ccc(cc1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
CNC(=O)c1ccc(cc1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
CCNC(=O)c1ccc(cc1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
O=C(NC1CC1)c1ccc(cc1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
O=C(NC1CCC1)c1ccc(cc1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
O=C(NC1CCCC1)c1ccc(cc1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
CN(C)C(=O)c1ccc(cc1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
O=C(N1CCCC1)c1ccc(cc1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
C[C@@H]1CCCN1C(=O)c1ccc(cc1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1 |r|
C[C@H]1CCCN1C(=O)c1ccc(cc1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1 |r|
Fc1cc(ccc1-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1)C(=O)N1CCCC1
Fc1cc(ccc1C(=O)N1CCCC1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
Clc1cc(ccc1C(=O)N1CCCC1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
CNC(=O)c1ccc(c(F)c1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
CNC(=O)c1ccc(cc1)-c1ccc2C(=O)N(CCN3CCC[C@H]3C)CCc2c1 |r|
CCNC(=O)c1ccc(cc1)-c1ccc2C(=O)N(CCN3CCC[C@H]3C)CCc2c1 |r|
C[C@@H]1CCCN1CCN1CCc2cc(ccc2C1=O)-c1ccc(cc1)C(=O)N1CCCC1 |r|
O=C1N(CCCN2CCCCC2)CCc2cc(ccc12)-c1ccc(cc1)C#N
CC(C)NC(=O)c1ccc(cc1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
O=C1N(CCN2CCCC2)CCc2cc(ccc12)-n1cnc2ccccc12
CN(C)C(=O)c1ccc(c(F)c1)-c1ccc2C(=O)N(CCN3CCCC3)CCc2c1
CC(O)c1cccc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Cc1nnc(o1)-c1cccc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
C1CCN(CC1)C1CCN(CC1)c1nnc(s1)-c1cccc2cnccc12
Cc1nnc2ccc(cn12)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Cc1nc2cc(ccc2o1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
C1CCN(CC1)C1CCN(CC1)c1nnc(s1)-c1cccc2ccnn12
C1CCN(CC1)C1CCN(CC1)c1nnc(s1)-c1cccc2cccnc12
CN(C)C(=O)c1cccc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
O=C(N1CCC1)c1cccc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
O=C(N1CCC1)c1cccc(n1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
CC(=O)Nc1cccc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
O=c1cccnn1-c1cccc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
O=C1Cc2cc(ccc2N1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
O=C1COc2ccc(cc2N1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
O=c1ccc2cc(ccc2[nH]1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
O=c1ccc2ccc(cc2[nH]1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
O=c1ccc2c(cccc2[nH]1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
O=c1ccoc2ccc(cc12)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
Cc1cc(=O)c2cc(ccc2o1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
O=c1ccnc2ccc(cn12)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
O=c1ccnc2c(cccn12)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
C(Cc1ccccc1)N1C2CCC1CC2
C[C@@H]1CCCN1CCCOc1ccc-2c(CCc3cc(=O)[nH]nc-23)c1 |r|
C[C@@H]1CCCN1CCCOc1ccc-2c(CCc3cc(=O)n(C)nc-23)c1 |r|
CC(C)n1nc-2c(CCc3cc(OCCCN4CCC[C@H]4C)ccc-23)cc1=O |r|
C[C@@H]1CCCN1CCCOc1ccc-2c(CCc3cc(=O)n(nc-23)-c2ccccc2)c1 |r|
O=c1cc2CCc3cc(OCCCN4CCCCC4)ccc3-c2nn1Cc1ccccc1
C[C@@H]1CCCN1CCCOc1ccc2C3=NNC(=O)CC3CCc2c1 |r,t:15|
C[C@@H]1CCCN1CCCOc1ccc-2c(CCc3n[nH]c(=O)cc-23)c1 |r|
O=C1CC2CCc3cc(OC4CCN(CC4)C4CCC4)ccc3C2=NN1 |c:27|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1CCC(F)(F)C1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1CCC(F)(F)CC1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1CCN(CC1)C(=O)c1ccccc1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1CCC(CC1)C#N |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1CCC(CC1)C(F)(F)F |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1CCCC(F)(F)C1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1CCN(CC1)C(C)=O |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1CCN(CC1)C(=O)C(F)(F)F |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1CCN(CC1)S(C)(=O)=O |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1CCN(CC1)C(=O)c1ccc(F)cc1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1CCN(CC1)C(=O)c1cccs1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1CCN(CC1)C(=O)c1ccco1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1CCN(CC1)C(=O)c1cccn1C |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1CCN(CC1)C(=O)c1cc2ccccc2s1 |r|
COC(=O)N1CCN(CC(=O)c2ccc(OCCCN3CCC[C@H]3C)cc2)CC1 |r|
CC(C)COC(=O)N1CCN(CC(=O)c2ccc(OCCCN3CCC[C@H]3C)cc2)CC1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1CCN(CC1)C(=O)Oc1ccccc1 |r|
C[C@@H]1CCCN1CCCOc1ccc(cc1)C(=O)CN1CCN(CC1)C(=O)Oc1ccc(F)cc1 |r|
CCOC(=O)N1CCN(CC(=O)c2ccc(OCCCN3CCC[C@H]3C)cc2)CC1 |r|
COCn1ncc(cc1=O)-c1ccc(OCCCN2CCC[C@H]2C)cc1 |r|
COCn1ncc(OC)c(-c2ccc(OCCCN3CCC[C@H]3C)cc2)c1=O |r|
COc1cn[nH]c(=O)c1-c1ccc(OCCCN2CCC[C@H]2C)cc1 |r|
C[C@H](COc1ccc(cc1)-c1cn[nH]c(=O)c1)CN1CCC[C@H]1C |r|
C[C@@H](COc1ccc(cc1)-c1cn[nH]c(=O)c1)CN1CCC[C@H]1C |r|
C[C@H](COc1ccc(cc1)-c1cn[nH]c(=O)c1)CN1CCCCC1 |r|
C[C@@H](COc1ccc(cc1)-c1cn[nH]c(=O)c1)CN1CCCCC1 |r|
COCn1ncc(-c2ccc(OCCCN3CCC[C@H]3C)cc2)c(OC)c1=O |r|
C1CCN(CC1)C1CCN(CC1)c1nnc(s1)N1CCOC(C1)c1ccccn1
C1CCN(CC1)C1CCN(CC1)c1nnc(s1)N1CCOC(C1)c1cnccn1
OC1(CCCN(C1)c1nnc(s1)N1CCC(CC1)N1CCCCC1)c1ncccn1
OC1(CCCN(C1)c1nnc(s1)N1CCC(CC1)N1CCCCC1)c1ccccn1
COC1(CCCN(C1)c1nnc(s1)N1CCC(CC1)N1CCCCC1)c1ccccn1
C1CCN(CC1)C1CCN(CC1)c1nnc(s1)N1CCCC(=C1)c1ccccn1 |c:24|
C1CCN(CC1)C1CCN(CC1)c1nnc(s1)N1CCC=C(C1)c1ncccn1 |c:23|
C1CCN(CC1)C1CCN(CC1)c1nnc(s1)N1CCC=C(C1)c1ccccn1 |c:23|
CC1CN(CC(C)O1)c1nnc(s1)N1CCC(CC1)N1CCCCC1
FC1CCCN(C1)c1nnc(s1)N1CCC(CC1)N1CCCCC1
OC1CCCN(C1)c1nnc(s1)N1CCC(CC1)N1CCCCC1
COC1CCCN(C1)c1nnc(s1)N1CCC(CC1)N1CCCCC1
C1CCN(CC1)C1CCN(CC1)c1nnc(s1)N1CCCC(C1)c1ccccc1
FC1(F)CCN(CC1)c1nnc(s1)N1CCC(CC1)N1CCCCC1
FC1(F)CCN(C1)c1nnc(s1)N1CCC(CC1)N1CCCCC1
O=C1CCCCN1c1nnc(s1)N1CCC(CC1)N1CCCCC1
O=C1N(CCCN1c1ccccc1)c1nnc(s1)N1CCC(CC1)N1CCCCC1
O=C1N(CCN1c1nnc(s1)N1CCC(CC1)N1CCCCC1)C1CCCC1
FC1(CCCN(C1)c1nnc(s1)N1CCC(CC1)N1CCCCC1)c1ccccn1
CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ncccc2c1=O |r|
COCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ncccc2c1=O |r|
CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2nccnc2c1=O |r|
Clc1ccc(Cc2nn(C[C@H]3CCCN3CCCCc3ccc(OCCCN4CCCCCC4)cc3)c(=O)c3ccncc23)cc1 |r|
CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O |r|
CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O |r|
COCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccccc2c1=O |r|
CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ccncc2c1=O |r|
CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cnccc2c1=O |r|
CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cnccc2c1=O |r|
COCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cnccc2c1=O |r|
CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cccnc2c1=O |r|
CCCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cccnc2c1=O |r|
COCCN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cccnc2c1=O |r|
CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2ncccc2c1=O |r|
CCN(CC)CCOc1ccc(CN2CCC(CC2)C2CCN(Cc3ccc(cc3)C(=O)NC(C)C)CC2)cc1
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)-c1cn[nH]c1 |r|
O=C(N[C@H](Cc1cscn1)C(=O)N1CCCN(CCCOc2ccc(cc2)-c2ccc(cc2)C#N)CC1)c1ccco1 |r|
C[C@@H]1CCCN1CCc1ccc2cc(ccc2c1)-n1ncccc1=O |r|
CS(=O)(=O)c1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(OC2CCN(CC2)C2CCC2)cc1
CC1(C)CCCN(CCCOc2ccc(cc2)C2CCN(CC2)C(=O)c2ccc(CCC(O)=O)c3ccccc23)C1
NC(NC(=O)CCCCCCCCCCCCCCC(=O)NC(=N)NCCCc1cnc[nH]1)=NCCCc1cnc[nH]1 |w:33.34|
NC(NC(=O)CCCCCCCCCCCCCCCCCCCCC(=O)NC(=N)NCCCc1cnc[nH]1)=NCCCc1cnc[nH]1 |w:39.40|
Cc1nc(N)sc1CCCN=C(N)NC(=O)CCCCCCCCC(=O)NC(N)=NCCCc1cnc[nH]1 |w:10.10,29.30|
NC(NC(=O)CCCCCCCCC(=O)NC(=N)NCCCc1cnc[nH]1)=NCCCc1cnc[nH]1 |w:27.28|
N=C(NCCCc1cnc[nH]1)NC(=O)CCCCCCC(=O)NC(=N)NCCCc1cnc[nH]1
N=C(NCCCc1cnc[nH]1)NC(=O)CCCCC(=O)NC(=N)NCCCc1cnc[nH]1
C([C@H]1C[C@H](C1)c1ccc(CN2CCCC2)cc1)N1CCOCC1 |r,wU:3.5,1.0,(12.44,-17.63,;13.93,-17.23,;14.7,-15.89,;16.03,-16.66,;15.26,-18,;17.52,-16.26,;18.61,-17.35,;20.1,-16.95,;20.5,-15.47,;21.98,-15.07,;23.07,-16.16,;22.83,-17.68,;24.2,-18.38,;25.29,-17.29,;24.59,-15.92,;19.41,-14.38,;17.92,-14.78,;11.35,-16.54,;11.75,-15.05,;10.66,-13.96,;9.18,-14.36,;8.78,-15.85,;9.87,-16.93,)|
CC(C)CNC(=O)[C@H]1C[C@](F)(C1)c1ccc(CN2CCCC2)c(F)c1 |r,wU:7.6,wD:9.9,(6.68,-19.62,;6.28,-18.13,;4.79,-17.73,;7.37,-17.04,;8.85,-17.44,;9.94,-16.35,;9.54,-14.87,;11.43,-16.75,;12.76,-15.98,;13.53,-17.32,;14.3,-18.65,;12.2,-18.09,;14.87,-16.55,;14.87,-15.01,;16.2,-14.24,;17.54,-15.01,;18.87,-14.24,;20.2,-15.01,;20.36,-16.54,;21.87,-16.86,;22.64,-15.52,;21.61,-14.38,;17.54,-16.55,;18.87,-17.32,;16.2,-17.32,)|
CCNC(=O)C1CC(C1)(c2ccc(c(c2)F)CN3CCCC3)F
CCN(C)C(=O)[C@H]1C[C@H](C1)c1ccc(CN2CCCC2)c(F)c1 |r,wU:6.5,8.10,(5.81,-12.97,;6.58,-14.3,;8.12,-14.3,;8.89,-12.97,;8.89,-15.64,;8.12,-16.97,;10.43,-15.64,;11.51,-14.55,;12.6,-15.64,;11.51,-16.72,;14.14,-15.64,;14.91,-14.3,;16.45,-14.3,;17.22,-15.64,;18.76,-15.64,;19.53,-14.3,;21.06,-14.14,;21.39,-12.63,;20.05,-11.86,;18.91,-12.89,;16.45,-16.97,;17.22,-18.3,;14.91,-16.97,)|
CN(C[C@H]1C[C@@H](C1)c1ccc(CN2CCCC2)c(Cl)c1)C(C)=O |r,wU:5.7,wD:3.2,(8.86,-17.88,;8.17,-16.51,;9.01,-15.22,;10.55,-15.3,;11.58,-16.45,;12.72,-15.42,;11.7,-14.28,;14.26,-15.51,;14.96,-16.88,;16.49,-16.97,;17.34,-15.68,;18.87,-15.77,;19.57,-17.14,;21.09,-17.39,;21.33,-18.91,;19.95,-19.6,;18.87,-18.51,;16.64,-14.31,;17.49,-13.02,;15.1,-14.22,;6.63,-16.42,;5.94,-15.05,;5.79,-17.71,)|
C(Oc1ncccn1)[C@H]1C[C@@H](C1)c1ccc(CN2CCCC2)cc1 |r,wU:10.13,wD:8.8,(11.52,-15.55,;10.75,-14.22,;9.21,-14.22,;8.44,-15.55,;6.9,-15.55,;6.13,-14.22,;6.9,-12.88,;8.44,-12.88,;13.06,-15.55,;14.15,-16.64,;15.24,-15.55,;14.15,-14.46,;16.78,-15.55,;17.55,-14.22,;19.09,-14.22,;19.86,-15.55,;21.4,-15.55,;22.17,-16.88,;23.7,-17.04,;24.02,-18.55,;22.68,-19.32,;21.54,-18.29,;19.09,-16.88,;17.55,-16.88,)|
CN(C)Cc1ccc(cc1)-c1ccc(CN(C)C)cc1
c1c2c(cc(c1F)N3CCNCC3)N(C=C(C2=O)C(=O)O)C4CC4
OC12C3C4C5C3C(C3C5CC4C13)N2Cc1ccccn1 |TLB:6:7:4.3:9,8:7:5.2:12,4:5:7.11:12,1:11:4.3:9,10:11:5.2:12,3:2:7.11:12,THB:5:4:7.11:9,2:3:7.11:9,13:12:5.2:7.11|
COc1ccccc1N1CCN(Cc2cc(CN3CCN(CC3)c3ccc(Cl)cc3)c3cccccc23)CC1
COc1ccccc1N1CCN(Cc2cc(CN3CCN(CC3)c3ccccc3OC)c3cccccc23)CC1
COc1ccccc1N1CCN(Cc2cc(CN3CCN(C)CC3)c3cccccc23)CC1
COc1ccccc1N1CCN(Cc2cc(CN3CCOCC3)c3cccccc23)CC1
COc1ccccc1N1CCN(Cc2cc(CN3CCCCC3)c3cccccc23)CC1
COc1ccccc1N1CCN(Cc2cc(CN(C)C)c3cccccc23)CC1
COc1ccccc1N1CCN(Cc2cc(CO)c3cccccc23)CC1
C(COC(c1ccccc1)c1ccccc1)Cc1cnc[nH]1
Brc1ccc(cc1)C(OCCCc1cnc[nH]1)c1ccccc1
Fc1ccc(cc1)C(OCCCc1cnc[nH]1)c1ccccc1
Fc1ccc(cc1)C(OCCCc1cnc[nH]1)c1ccc(F)cc1
Clc1ccc(cc1)C(OCCCc1cnc[nH]1)c1ccccc1
C(COCc1cccc2ccccc12)Cc1cnc[nH]1
FC(F)(F)c1ccc(cc1)C(OCCCc1cnc[nH]1)c1ccccc1
O=C(CCCc1ccccn1)NCCc1cnc[nH]1
C(CCc1ccccc1)CNCCc1cnc[nH]1
O=C(Cc1ccccc1)NCCc1cnc[nH]1
O=C(CCC(c1ccccc1)c1ccccc1)NCCc1cnc[nH]1
O=C(CCCc1ccccc1)NCCc1cnc[nH]1
O=C(CCCc1cnc[nH]1)NCCc1cnc[nH]1
O=C(CCCCc1ccccc1)NCCc1cnc[nH]1
O=C(CCCC1CCCCC1)NCCc1cnc[nH]1
O=C(CCc1ccccc1)NCCc1cnc[nH]1
CN(CC#C)Cc1cc2cc(OCCCN3CCCCC3)ccc2n1C
CC(C)COCCCc1cnc[nH]1
CC(C)CCCOCCCc1cnc[nH]1
CC(C)CCOCCCc1cnc[nH]1
CNC(=S)NCCCCCc1cnc[nH]1
O=C(NCCCc1cnc[nH]1)NC1CCCCC1
Clc1ccccc1CNC(=S)N1CCC(CC1)c1cnc[nH]1
Clc1ccc(CNC(=S)N2CCC(CC2)c2cnc[nH]2)cc1
CC(C)C(NC(=O)OCCCc1cnc[nH]1)C(C)C
CC1(C)C(NC(=O)OCCCc2cnc[nH]2)C1(C)C
C[C@H](NC(=O)OCCCc1cnc[nH]1)C1CCCCC1 |r|
CC(NC(=O)OCCCN1CCCCC1)C(C)(C)C
C[C@H](NC(=O)OCCCc1cnc[nH]1)C(C)(C)C |r|
CC(C)C(C)NC(=O)OCCCc1cnc[nH]1
CC(=O)c1cccc(OCCCc2cnc[nH]2)c1
CCC(C)N1CCC(CC1)Oc1ccc(cc1)C#N
N#Cc1ccc(OCCCCCN2CCCC2)cc1
CC(C)N1CCC(CC1)Oc1ccc(CN2CCCCCC2)cc1
CCN(CC)Cc1ccc(OC2CCN(CC2)C(C)C)cc1
N#Cc1ccc(OC2CCN(CC2)C2CCCCC2)cc1
CC(CO)N1CCC(CC1)Oc1ccc(cc1)C#N
CC(C)N1CCC(CC1)Oc1ccc(CNc2ccccn2)cc1
CC(C)N1CCC(CC1)Oc1ccc(CN2CCN(CC2)c2ccccc2)cc1
CC(C)N1CCC(CC1)Oc1ccc(CN2CCC(O)CC2)cc1
C[C@@H]1CCCN1CCc1cc2cc(ccc2o1)C#N
CC(C)N1CCC(CC1)Oc1ccc(CN2CCCN(C)CC2)cc1
CC(C)N1CCC(CC1)Oc1ccc(CNc2ccccc2)cc1
CC(C)N1CCC(CC1)Oc1ccc(CN2CCC(Cc3ccccc3)CC2)cc1
CC(C)N1CCC(CC1)Oc1ccc(CN2CCN(Cc3ccccc3)CC2)cc1
CC(C)N1CCC(CC1)Oc1ccc(CN2CCCCC2)cc1
N#Cc1ccc(OC2CCN(Cc3ccccc3)CC2)cc1
CC(C)N1CCC(CC1)Oc1ccc(CN2CCC(CO)CC2)cc1
CCCCN(C)Cc1ccc(OC2CCN(CC2)C(C)C)cc1
N#Cc1ccc(OC2CCNCC2)cc1
CC(C)N1CCC(CC1)Oc1ccc(CNC2CC2)cc1
CCCN1CCC(CC1)Oc1ccc(cc1)C#N
CC(C)N1CCC(CC1)Oc1ccc(CN(C)CCN(C)C)cc1
CN1CCC(CC1)Oc1ccc(cc1)C#N
CC(C)N1CCC(CC1)Oc1ccc(CN2CCCC2)cc1
CC(C)N1CCC(CC1)Oc1ccc(CN2CCN(C)CC2)cc1
CC(C)CN1CCC(CC1)Oc1ccc(cc1)C#N
CC(C)N1CCC(CC1)Oc1ccc(cc1)C#N
N#Cc1ccc(OC2CCN(CC2)C2CCCC2)cc1
CCN1CCC(CC1)Oc1ccc(cc1)C#N
CC(C)N1CCC(CC1)Oc1ccc(CN(C)C)cc1
C[C@@H]1CCCN1CCCOc1ccc(cc1)N1CCN(CC1=O)C(=O)c1ccc(F)cc1
Fc1ccc(cc1)C(=O)N1CCN(C(=O)C1)c1ccc(OCCCN2CCCCC2)cc1
Fc1ccc(cc1)C(=O)N1CCN(C(=O)C1)c1ccc(OCCCN2CCCC2)cc1
C(N1CCCCC1)c1ccc(cc1)-c1ccc(CN2CCCCC2)cc1
CCN(CC)Cc1ccc(cc1)-c1ccc(CN(CC)CC)cc1
CCCN(CCC)Cc1ccc(cc1)-c1ccc(CN(CCC)CCC)cc1
CCCCCNCc1ccc(cc1)-c1ccc(CNCCCCC)cc1
C(NC1CCCCC1)c1ccc(cc1)-c1ccc(CNC2CCCCC2)cc1
CC1CC(C)CN(Cc2ccc(cc2)-c2ccc(CN3CC(C)CC(C)C3)cc2)C1
C(CCCCN1CCCCC1)CCCCN1CCCCC1
CC1CCN(Cc2ccc(cc2)-c2ccc(CN3CCC(C)CC3)cc2)CC1
C(N1CCOCC1)c1ccc(cc1)-c1ccc(CN2CCOCC2)cc1
CC(=O)N1CCN(Cc2ccc(cc2)-c2ccc(CN3CCN(CC3)C(C)=O)cc2)CC1
CN(Cc1ccc(cc1)-c1ccc(CN(C)C2CCCCC2)cc1)C1CCCCC1
CN(Cc1ccc(cc1)-c1ccc(CN2CCCCC2)cc1)C1CCCCC1
CC1CC(C)CN(Cc2ccc(cc2)-c2ccc(CN3CCCCC3)cc2)C1
C(N1CCCCC1)c1ccc(cc1)-c1ccc(CN2CCOCC2)cc1
CCCN(CCC)Cc1ccc(cc1)-c1ccc(CN2CCCCC2)cc1
CC1CCN(Cc2ccc(cc2)-c2ccc(CN3CCCCC3)cc2)CC1
CC(=O)N1CCN(Cc2ccc(cc2)-c2ccc(CN3CCCCC3)cc2)CC1
C(NC1CCCCC1)c1ccc(cc1)-c1ccc(CN2CCCCC2)cc1
C(Cc1ccc(cc1)-c1ccc(CCN2CCCCC2)cc1)N1CCCCC1
CN(C)CCc1ccc(cc1)-c1ccc(CCN(C)C)cc1
C(Cc1ccc(cc1)-c1ccc(CN2CCCCC2)cc1)N1CCCCC1
CCCN(CCC)Cc1ccc(cc1)-c1ccc(CC(=O)N2CCCCC2)cc1
CCCN(CCC)Cc1ccc(cc1)-c1ccc(CCN2CCCCC2)cc1
CN(C)Cc1ccc(cc1)-c1ccc(CN2CCCCC2)cc1
CCN(CC)Cc1ccc(cc1)-c1ccc(CN2CCCCC2)cc1
CN(Cc1ccccc1)Cc1ccc(cc1)-c1ccc(CN2CCCCC2)cc1
O=C1CCCCN1Cc1ccc(cc1)-c1ccc(CN2CCCCC2)cc1
N#Cc1ccc(OCc2ccc(cc2)-c2ccc(CN3CCCCC3)cc2)cc1
CC1CCN(CCc2ccc(cc2)-c2ccc(CCN3CCC(C)CC3)cc2)CC1
CCCN(CCC)C(=O)Cc1ccc(cc1)-c1ccc(CN2CCCCC2)cc1
COc1ccc(CN=C(N)SCCCc2cnc[nH]2)cc1 |w:7.6|
N=C(NCCc1ccccc1)SCCCc1cnc[nH]1
NC(SCCCc1cnc[nH]1)=NCCc1ccc(Cl)cc1 |w:11.12|
NC(SCCCc1cnc[nH]1)=NCCc1ccc(Br)cc1 |w:11.12|
Cc1ccc(CCN=C(N)SCCCc2cnc[nH]2)cc1 |w:7.6|
COc1ccc(CCN=C(N)SCCCc2cnc[nH]2)cc1 |w:8.7|
NC(=NCCCc1cnc[nH]1)N=CC(c1ccccc1)c1ccccc1 |w:2.2,11.11|
N=C(NCCC(c1ccccc1)c1ccccc1)SCCCc1cnc[nH]1
N=C(NCCCc1ccccc1)SCCCc1cnc[nH]1
NC(SCCCc1cnc[nH]1)=NCCCCc1ccccc1 |w:11.12|
N=C(NCc1ccccc1)SCCCc1cnc[nH]1
NC(NCc1ccccc1)=NCCCc1cnc[nH]1 |w:10.11|
NC(SCCCc1cnc[nH]1)=NCc1ccc(F)cc1 |w:11.12|
NC(SCCCc1cnc[nH]1)=NCc1cccc(Cl)c1 |w:11.12|
NC(SCCCc1cnc[nH]1)=NCc1ccc(Cl)c(Cl)c1 |w:11.12|
NC(SCCCc1cnc[nH]1)=NCc1ccc(Br)cc1 |w:11.12|
Cc1ccc(CN=C(N)SCCCc2cnc[nH]2)cc1 |w:6.5|
NC(SCCCc1cnc[nH]1)=NCc1ccccc1Cl |w:11.12|
NC(SCCCc1cnc[nH]1)=NCc1ccc(I)cc1 |w:11.12|
CCN(CC)S(=O)(=O)c1cccc(c1)-c1ccc(CCN2CCCC2C)cc1
CC1CCCN1CCc1ccc(cc1)-c1cccc(c1)S(=O)(=O)N1CCCCC1
CCNS(=O)(=O)c1cccc(c1)-c1ccc(CCN2CCCC2C)cc1
CC(C)NS(=O)(=O)c1cccc(c1)-c1ccc(CCN2CCCC2C)cc1
CC(C)NS(=O)(=O)c1ccc(cc1)-c1ccc(CCN2CCCC2C)cc1
CCN(CC)S(=O)(=O)c1ccc(cc1)-c1ccc(CCN2CCCC2C)cc1
CC1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)N1Cc2ccccc2C1
CC1CCCN1CCc1ccc(cc1)-c1ccc(cc1)S(=O)(=O)NC(C)(C)CO
C(CN1CCCCC1)C#Cc1ccccc1
C(CN1CCCCC1)C#Cc1ccccc1N1CCCCC1
C(CN1CCCCC1)C#Cc1cccc(CN2CCCC2)c1
NC(=O)C1CCN(Cc2cccc(c2)C#CCCN2CCCCC2)CC1
CN1CCN(Cc2cccc(c2)C#CCCN2CCCCC2)CC1
C(CN1CCCCC1)C#Cc1cccc(CN2CCCCC2)c1
OC1CCN(Cc2ccc(cc2)C#CCCN2CCCCC2)CC1
NC(=O)C1CCN(Cc2ccc(cc2)C#CCCN2CCCCC2)CC1
C(CN1CCCCC1)C#Cc1ccc(CN2CCC(Cc3ccccc3)CC2)cc1
C(CN1CCCCC1)C#Cc1ccc(CN2CCN(Cc3ccccc3)CC2)cc1
CN1CCN(Cc2ccc(cc2)C#CCCN2CCCCC2)CC1
C(CN1CCCCC1)C#Cc1ccc(CN2CCOCC2)cc1
C(CN1CCCCC1)C#Cc1ccc(CN2CCCC2)cc1
CCN(CC)Cc1ccc(cc1)C#CCCN1CCCCC1
CN(C)Cc1ccc(cc1)C#CCCN1CCCCC1
C(CN1CCOCC1)C#Cc1cccc(CN2CCCCC2)c1
CN1CCN(CCC#Cc2ccc(CN3CCCCC3)cc2)CC1
C(CN1CCOCC1)C#Cc1ccc(CN2CCCCC2)cc1
C(CN1CCSCC1)C#Cc1ccc(CN2CCCCC2)cc1
C(CN1CCCC1)C#Cc1ccc(CN2CCCCC2)cc1
CCN(CC)CCC#Cc1ccc(CN2CCCCC2)cc1
CC(C)N1CCN(Cc2ccc(cc2)C#CCCN2CCCCC2)CC1
NC(NC#N)=NCCCCc1cnc[nH]1 |w:5.5|
Nc1nc2C(CCCCc2c(n1)N1CCNCC1)c1ccccc1
N[C@@H]1CCN(C1)c1nc(N)nc2c1CCCC21CCCC1 |r|
CN[C@@H]1CCN(C1)c1nc(N)nc2CC(CCCc12)c1ccccc1 |r|
CN[C@@H]1CCN(C1)c1nc(N)nc2c1CCCC21CCCC1 |r|
CNC1CN(C1)c1nc(N)nc2c1CCCC21CCCC1
C[C@H](CC(=O)NC(N)=NCCCc1cnc[nH]1)c1ccccc1 |r,w:8.8|
C[C@@H](CC(=O)NC(N)=NCCCc1cnc[nH]1)c1ccccc1 |r,w:8.8|
C[C@H](CC(=O)NC(N)=NCCCc1cnc[nH]1)C1CCCCC1 |r,w:8.8|
C[C@@H](CC(=O)NC(N)=NCCCc1cnc[nH]1)C1CCCCC1 |r,w:8.8|
C[C@H](CC(=O)NC(N)=NCCCc1sc(N)nc1C)c1ccccc1 |r,w:8.8|
C[C@@H](CC(=O)NC(N)=NCCCc1sc(N)nc1C)c1ccccc1 |r,w:8.8|
C[C@@H](CC(=O)NC(N)=NCCCc1sc(N)nc1C)C1CCCCC1 |r,w:8.8|
C[C@H](CC(=O)NC(N)=NCCCc1sc(N)nc1C)C1CCCCC1 |r,w:8.8|
C(Cc1cnc[nH]1)Cn1cc(Cc2ccccc2)nn1
C(CCn1cc(Cc2ccccc2)nn1)Cc1cnc[nH]1
C(Cc1cnc[nH]1)Cn1cc(CN2CCCCC2)nn1
CN1CCN(Cc2cn(CCCc3cnc[nH]3)nn2)CC1
CC(C)(C)c1cn(CCCc2cnc[nH]2)nn1
CCCCCc1cn(CCCc2cnc[nH]2)nn1
C(Cc1cnc[nH]1)Cn1cc(CC2CCCCC2)nn1
C(Cn1cc(CC2CCCCC2)nn1)c1cnc[nH]1
C(CCn1cc(CC2CCCCC2)nn1)Cc1cnc[nH]1
C(Cc1cnc[nH]1)Cn1cc(nn1)C1CCCCC1
C(Cc1cnc[nH]1)Cn1cc(CCC2CCCCC2)nn1
CCCCCCCc1cn(CCCc2cnc[nH]2)nn1
CC(C1CCCCC1)c1cn(CCCc2cnc[nH]2)nn1
C(Cc1cnc[nH]1)Cn1cc(CC2CCCCCC2)nn1
C(Cc1cnc[nH]1)Cn1cc(CC2CCCC2)nn1
C(Cn1cc(CC2CCCC2)nn1)c1cnc[nH]1
CC(C1CCCCC1)c1cn(CCc2cnc[nH]2)nn1
C(Cn1ccnc1)Cn1cc(CC2CCCCC2)nn1
C(CN1CCOCC1)Cn1cc(CC2CCCCC2)nn1
CN1CCN(CCCn2cc(CC3CCCCC3)nn2)CC1
C(CN1CCCCC1)Cn1cc(CC2CCCCC2)nn1
C(CN1CCCCC1)Cn1cc(CN2CCCCC2)nn1
C(Cn1cc(Cc2ccccc2)nn1)c1cnc[nH]1
[#7]\[#6](-[#7])=[#7]\[#6]-[#6]-[#16]-[#6](-[#7])=[#7]
Clc1ccc(CN=C(NC2CCCCC2)SCCCc2cnc[nH]2)cc1 |w:6.5|
C(CSC(NC1CCCCC1)=NCc1ccccc1)Cc1cnc[nH]1 |w:11.12|
CCCCN=C(NC1CCCC1)SCCCc1cnc[nH]1 |w:4.3|
CCCCN=C(NCc1ccc(Cl)cc1)SCCCc1cnc[nH]1 |w:4.3|
Clc1ccc(CNC(SCCCc2cnc[nH]2)=NCc2ccccc2)cc1 |w:17.18|
Clc1ccc(CNC(SCCCc2cnc[nH]2)=NCc2ccccc2)cc1Cl |w:17.18|
C(CSC(NC1CCCC1)=NC1CCCCC1)Cc1cnc[nH]1 |w:10.11|
CC(C)(C)N=C(NC1CCCC1)SCCCc1cnc[nH]1 |w:4.3|
CCCCN=C(NCc1ccc(Cl)c(Cl)c1)SCCCc1cnc[nH]1 |w:4.3|
N#Cc1ccc(CNC(SCCCc2cnc[nH]2)=NC2CCCCC2)cc1 |w:18.19|
C(CSC(NC1CCCC1)=NCc1ccccc1)Cc1cnc[nH]1 |w:10.11|
Clc1ccc(CNC(SCCCc2cnc[nH]2)=NC2CCCCC2)cc1Cl |w:17.18|
[O-][N+](=O)c1ccc(CNC(SCCCc2cnc[nH]2)=NC2CCCCC2)cc1 |w:19.20|
CCCC[C@H](N1CCC[C@H]1C)c1ccc(cc1)-c1ccc(CN2CCCCC2)cc1 |r|
CCCCC(N1CCCCC1)c1ccc(cc1)-c1ccc(C)cc1
COc1ccc(OCCC[C@H](N2CCC[C@@H]2C)c2ccc(cc2)-c2ccc(CN3CCCCC3)cc2)cc1 |r|
COc1ccc(OCCC[C@@H](N2CCC[C@@H]2C)c2ccc(cc2)-c2ccc(CN3CCCCC3)cc2)cc1 |r|
C[C@H]1CCCN1[C@@H](CCCOc1ccccc1)c1ccc(cc1)-c1ccc(CN2CCCCC2)cc1 |r|
C[C@H]1CCCN1[C@H](CCCOc1ccccc1)c1ccc(cc1)-c1ccc(CN2CCCCC2)cc1 |r|
COCCC[C@@H](N1CCC[C@@H]1C)c1ccc(cc1)-c1ccc(CN2CCCCC2)cc1 |r|
CCCC[C@H](N1CCCC[C@@H]1C)c1ccc(cc1)-c1ccc(CN2CCCCC2)cc1 |r|
CCCC[C@@H](N1CCCC[C@@H]1C)c1ccc(cc1)-c1ccc(CN2CCCCC2)cc1 |r|
CCCC[C@H](N1CCC[C@@H]1C)c1ccc(cc1)-c1ccc(CN2CCCCC2)cc1 |r|
CCCC[C@@H](N1CCC[C@H]1C)c1ccc(cc1)-c1ccc(CN2CCCCC2)cc1 |r|
C[C@@H]1CCCN1Cc1ccc(cc1)-c1ccc(cc1)C(Cc1ccccc1)N1CCCCC1 |r|
CN(C)C(Cc1ccccc1)c1ccc(cc1)-c1ccc(CN2CCCCC2)cc1
C(C(N1CCCCC1)c1ccc(cc1)-c1ccc(CN2CCCCC2)cc1)c1ccccc1
C[C@@H]1CCCN1Cc1ccc(cc1)-c1ccc(CN2CCCCC2)cc1 |r|
CCCCCc1ccc(cc1)-c1ccc(CN2CCCCC2)cc1
COCCC[C@H](N1CCC[C@@H]1C)c1ccc(cc1)-c1ccc(CN2CCCCC2)cc1 |r|
CCCC[C@@H](N1CCC[C@@H]1C)c1ccc(cc1)-c1ccc(CN2CCCCC2)cc1 |r|
CCCCC(N1CCCCC1)c1ccc(cc1)-c1ccc(CN2CCCCC2)cc1
C[C@H]1CCCN1Cc1ccc(cc1)-c1ccc(CN2CCCCC2)cc1 |r|
Cc1c(O)c(=O)ccn1-c1ccc(OCCCN2CCCC2)cc1
C(CCNC1CCCCCC1)CCc1cnc[nH]1
CC(C)CNCCCCc1cnc[nH]1
Nc1nc(N2CCNCC2)c2cc([nH]c2n1)-c1ccc(F)cc1
CN1CCN(CC1)c1cc(N)nc(N)n1
CC1=CC(C)=[N+]2C1=C(c1c(C)cc(C)n1[B-]2(F)F)c1ccc(OCCCN2CCCCC2)cc1 |c:4,t:1,7|
O=C1\C(Cc2ccccc12)=C\c1ccc(OCCCN2CCCCC2)cc1
O=C1\C(Cc2ccc(OCCN3CCCCC3)cc12)=C\c1ccccc1
O=C1CCc2cc(OCCCN3CCCCC3)ccc12
O=C1CCc2cc(OCCN3CCCC3)ccc12
O=C1CCc2ccc(OCCCN3CCCCC3)cc12
O=C(C1CC1)c1ccc(OCCCN2CCCCC2)cc1
O=C(C1CC1)c1ccc(OCCCc2c[nH]cn2)cc1
Brc1ccc(COc2ccc3C\C(=C/c4ccc(OCCCN5CCCCC5)cc4)C(=O)c3c2)cc1
Fc1ccc2C(=O)\C(Cc2c1)=C\c1ccc(OCCCN2CCCCC2)cc1
COc1ccc2C\C(=C/c3ccc(OCCCN4CCCCC4)cc3)C(=O)c2c1
O=C1\C(Cc2ccc(OCCCN3CCCCC3)cc12)=C\c1ccccc1
COc1ccc2C(=O)\C(Cc2c1)=C\c1ccc(OCCCN2CCCCC2)cc1
Brc1ccc(COc2ccc3C(=O)\C(Cc3c2)=C\c2ccc(OCCCN3CCCCC3)cc2)cc1
O=C1CCc2ccc(OCCN3CCCC3)cc12
O=C1CCc2cc(OCCN3CCCCC3)ccc12
O=C1\C(Cc2cc(OCCCN3CCCCC3)ccc12)=C\c1ccccc1
OC(C=C)c1ccc(OCCCN2CCCCC2)cc1
CCC(O)(CC)c1ccc(OCCCN2CCCCC2)cc1
OC1(CCCC1)c1ccc(OCCCN2CCCCC2)cc1
O[C@H]1CC[C@@H](CC1)c1ccc(OCCCN2CCCCC2)cc1 |r,wU:1.0,wD:4.7,(47.57,-42.13,;46.23,-42.89,;46.22,-44.43,;44.89,-45.19,;43.57,-44.41,;43.56,-42.88,;44.9,-42.11,;42.23,-45.18,;42.22,-46.72,;40.89,-47.49,;39.56,-46.71,;38.23,-47.47,;36.9,-46.7,;35.56,-47.46,;34.23,-46.69,;32.89,-47.46,;31.56,-46.68,;30.23,-47.46,;30.23,-49,;31.56,-49.76,;32.89,-49,;39.56,-45.17,;40.89,-44.41,)|
OC1CCC(Cc2ccc(OCCCN3CCCCC3)cc2)CC1 |(69.59,-45.6,;68.26,-44.82,;66.92,-45.58,;65.59,-44.81,;65.6,-43.27,;64.27,-42.5,;62.93,-43.27,;62.93,-44.81,;61.59,-45.58,;60.27,-44.8,;58.93,-45.56,;57.6,-44.79,;56.26,-45.56,;54.93,-44.78,;53.6,-45.55,;52.27,-44.77,;50.94,-45.55,;50.94,-47.09,;52.27,-47.85,;53.6,-47.09,;60.26,-43.27,;61.59,-42.5,;66.93,-42.5,;68.26,-43.28,)|
OC(CC=C)(CC=C)c1ccc(OCCCN2CCCCC2)cc1
CCCC(O)(CCC)c1ccc(OCCCN2CCCCC2)cc1
CCN(CC)CCOc1ccc(NC(=S)Nc2ccc(OCC(C)C)cc2)cc1
Fc1ccc(NC(=O)Nc2ccc(OCCCN3CCCCC3)cc2)c(F)c1
Cc1c(Cl)cc(NC(=O)Nc2ccc(OCCCN3CCCCC3)cc2)cc1Cl
CC1CCCN1C1CCN(C1)c1ccc(NC(=O)c2cc(F)ccc2C)c(C)c1
CC1CCCN1C1CCN(C1)c1ccc(NC(=O)c2ccccc2F)c(C)c1
C[C@@H]1CCCN1[C@@H]1CCN(C1)c1ccc(NC(=O)c2cc(F)ccc2C)c(C)c1 |r|
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(NC(=O)c2cc(F)ccc2C)c(C)c1 |r|
C[C@H]1CCCN1[C@@H]1CCN(C1)c1ccc(NC(=O)c2cc(F)ccc2C)c(C)c1 |r|
C[C@@H]1CCCN1[C@H]1CCN(C1)c1ccc(NC(=O)c2cc(F)ccc2C)c(C)c1 |r|
Nc1cc(CN2CCC(F)(CC2)C(=O)N2CCC(CC2)N2Cc3ccc(F)cc3C2)ccn1
Nc1cc(CN2CCC(F)(CC2)C(=O)N2CCC(CC2)N2Cc3ccccc3C2)ccn1
Nc1cc(CN2CCC(F)(CC2)C(=O)N2CCC(CC2)N2CCc3ccc(cc3C2)C#N)ccn1
Nc1cc(CN2CCC(F)(CC2)C(=O)N2CCC(CC2)N2CCc3ccccc3C2)ccn1
Nc1cc(CN2CCC(F)(CC2)C(=O)N2CCC(CC2)N2CCNc3ccccc3C2)ccn1
COc1ccc2CN(CCCc2c1)C1CCN(CC1)C(=O)C1(F)CCN(Cc2ccnc(N)c2)CC1
COc1ccc2CCCN(Cc2c1)C1CCN(CC1)C(=O)C1(F)CCN(Cc2ccnc(N)c2)CC1
Nc1cc(CN2CCC(F)(CC2)C(=O)N2CCC(CC2)N2CCc3ccccc3CC2)ccn1
Nc1cc(CN2CCC(F)(CC2)C(=O)N2CCC(CC2)N2CCCc3ccccc3C2)ccn1
Cc1nnc2CN(C3CCN(CC3)C(=O)C3(F)CCN(Cc4ccnc(N)c4)CC3)C(=O)c3ccsc3-n12
Cc1nnc2CN(Cc3ccsc3-n12)C1CCN(CC1)C(=O)C1(F)CCN(Cc2ccnc(N)c2)CC1
Nc1cc(CN2CCC(F)(CC2)C(=O)N2CCC(CC2)N2c3ccccc3Sc3cccnc23)ccn1
Nc1cc(CN2CCC(F)(CC2)C(=O)N2CCC(CC2)N2c3ccccc3Sc3ccc(cc23)C(F)(F)F)ccn1
Nc1cc(CN2CCC(F)(CC2)C(=O)N2CCC(CC2)N2Cc3ccccc3-c3ccccc3C2)ccn1
Nc1cc(CN2CCC(F)(CC2)C(=O)N2CCC(CC2)N2Cc3ccccc3Cc3ccccc23)ccn1
Nc1cc(CN2CCC(F)(CC2)C(=O)N2CCC(CC2)N2c3ccccc3Sc3ccccc23)ccn1
Cn1c2CCN(CCc2c2ccccc12)C1CCN(CC1)C(=O)C1(F)CCN(Cc2ccnc(N)c2)CC1
Nc1cc(CN2CCC(F)(CC2)C(=O)N2CCC(CC2)N2Cc3cccnc3C2)ccn1
Nc1cc(CN2CCC(CC2)C(=O)N2CCC(CC2)n2c3ccc(F)cc3n(-c3cc(F)cc(F)c3)c2=O)ccn1
Nc1cc(CN2CCC(CC2)C(=O)N2CCC(CC2)n2c3ccc(F)cc3n(-c3ccc(F)c(F)c3)c2=O)ccn1
Nc1cc(CN2CCC(CC2)C(=O)N2CCC(CC2)n2c3ccc(F)cc3n(CC3CCCCC3)c2=O)ccn1
Nc1cc(CN2CCC(CC2)C(=O)N2CCC(CC2)n2c3ccc(F)cc3n(C3CCCC3)c2=O)ccn1
Nc1cc(CN2CCC(CC2)C(=O)N2CCC(CC2)n2c3ccc(F)cc3n(CC3CC3)c2=O)ccn1
Nc1cc(CN2CCC(CC2)C(=O)N2CCC(CC2)n2c3ccc(F)cc3n(CC(F)(F)F)c2=O)ccn1
CC(C)Cn1c2cc(F)ccc2n(C2CCN(CC2)C(=O)C2CCN(Cc3ccnc(N)c3)CC2)c1=O
Nc1cc(CN2CCC(CC2)C(=O)N2CCC(CC2)n2c3ccc(F)cc3n(CCCC(F)(F)F)c2=O)ccn1
Nc1cc(CN2CCC(CC2)C(=O)N2CCC(CC2)n2c3ccc(F)cc3n(CCN3CCOCC3)c2=O)ccn1
Nc1cc(CN2CCC(CC2)C(=O)N2CCC(CC2)n2c3ccccc3n(CCN3CCOCC3)c2=O)ccn1
COCCn1c2ccccc2n(C2CCN(CC2)C(=O)C2CCN(Cc3ccnc(N)c3)CC2)c1=O
CC(c1ccc(cc1)-c1ccc(F)cc1)n1c2ccccc2n(C2CCN(CC2)C(=O)C2CCN(Cc3ccnc(N)c3)CC2)c1=O
Nc1cc(CN2CCC(CC2)C(=O)N2CCC(CC2)n2c3ccccc3[nH]c2=O)ccn1
CC(c1ccc(Cl)c(Cl)c1)n1c2ccccc2n(C2CCN(CC2)C(=O)C2CCN(Cc3ccnc(N)c3)CC2)c1=O
Nc1cc(CN2CCC(CC2)C(=O)N2CCC(CC2)n2c3ccccc3n(CCCC(F)(F)F)c2=O)ccn1
Nc1cc(CN2CCC(CC2)C(=O)N2CCC(CC2)n2c3ccc(F)cc3n(-c3ncccn3)c2=O)ccn1
Nc1cc(CN2CCC(CC2)C(=O)N2CCC(CC2)n2c3ccc(F)cc3n(-c3ccccn3)c2=O)ccn1
Nc1cc(CN2CCC(CC2)C(=O)N2CCC(CC2)n2c3ccc(F)cc3n(Cc3ccccc3)c2=O)ccn1
Nc1cc(CN2CCC(CC2)C(=O)N2CCC(CC2)n2c3ccccc3n(Cc3ccc(Cl)cc3)c2=O)ccn1
Nc1cc(CN2CCC(CC2)C(=O)N2CCC(CC2)n2c3ccc(F)cc3n(-c3cnccn3)c2=O)ccn1
C[C@H]1CCCN1[C@H]1CCN(C1)c1ccc(NC(=O)c2c(C)noc2C)c(C)c1 |r|
O=C(N1CCOCC1)N1CCC(CC1)Oc1ccc2CCN(CCc2c1)C1CCC1
O=C1CCCN1c1ccc(Oc2ccc3CCN(CCc3c2)C2CCCC2)nc1
O=C1CCCCN1c1ccc(Oc2ccc3CCN(CCc3c2)C2CCC2)nc1
O=C1CCN1c1ccc(Oc2ccc3CCN(CCc3c2)C2CCC2)nc1
CC1CCC(=O)N1c1ccc(Oc2ccc3CCN(CCc3c2)C2CCC2)nc1
O[C@H]1CN(C(=O)C1)c1ccc(Oc2ccc3CCN(CCc3c2)C2CCC2)nc1 |r|
CN1CCN(C1=O)c1ccc(Oc2ccc3CCN(CCc3c2)C2CCC2)nc1
O=C1OCCN1c1ccc(Oc2ccc3CCN(CCc3c2)C2CCC2)nc1
C1CC(C1)N1CCc2ccc(Oc3ccc(cn3)-c3cc[nH]n3)cc2CC1
C1CC(C1)N1CCc2ccc(Oc3ccc(cn3)-n3cccn3)cc2CC1
Cc1noc(C)c1-c1ccc(Oc2ccc3CCN(CCc3c2)C2CCC2)nc1
Cc1nnc(o1)-c1ccc(Oc2ccc3CCN(CCc3c2)C2CCC2)nc1
CCNC(=O)c1ccc(Oc2ccc3CCN(CCc3c2)C2CCC2)cn1
CNC(=O)c1ccc(Oc2ccc3CCN(CCc3c2)C2CCC2)cn1
CNC(=O)c1ccc(Oc2ccc3CCN(CCc3c2)C2CCC2)nn1
CNC(=O)c1ccc(Oc2ccc3CCN(CCc3c2)C2CCC2)cc1
CC(=O)c1ccc(Oc2ccc3CCN(CCc3c2)C2CCC2)cn1
CC(=O)Nc1ccc(Oc2ccc3CCN(CCc3c2)C2CCC2)nc1
CC(C)NC(=O)c1ccc(Oc2ccc3CCN(CCc3c2)C2CCC2)nc1
CCN(C)C(=O)c1ccc(Oc2ccc3CCN(CCc3c2)C2CCC2)nc1
O=C(N1CCCC1)c1ccc(Oc2ccc3CCN(CCc3c2)C2CCC2)nc1
NC(=O)c1ccc(Oc2ccc3CCN(CCc3c2)C2CCC2)nc1
Cc1nc(Oc2ccc3CCN(CCc3c2)C2CCC2)ccc1C#N
CN1N=C(C2CC2C1=O)c1ccc(OC2CCN(CC2)C2CCCC2)cc1 |c:2|
O=C1NN=C(C2CC12)c1ccc(OC2CCN(CC2)C2CCCC2)cc1 |c:3|
CC(C)N1CCC(CC1)Oc1ccc(cc1)C1=NN(C)C(=O)C2CC12 |t:18|
CC(C)N1CCC(CC1)Oc1ccc(cc1)C1=NNC(=O)C2CC12 |t:18|
CCN1CCC(CC1)Oc1ccc(cc1)C1=NNC(=O)C2CC12 |t:17|
Fc1ccc(cc1)N1N=C(C2CC2C1=O)c1ccc(OC2CCN(CC2)C2CCC2)cc1 |c:9|
CC(C)N1N=C(C2CC2C1=O)c1ccc(OC2CCN(CC2)C2CCC2)cc1 |c:4|
CCN1N=C(C2CC2C1=O)c1ccc(OC2CCN(CC2)C2CCC2)cc1 |c:3|
CN1N=C(C2CC2C1=O)c1ccc(OC2CCN(CC2)C2CCC2)cc1 |c:2|
O=C1NN=C([C@@H]2C[C@H]12)c1ccc(OC2CCN(CC2)C2CCC2)cc1 |r,c:3|
O=C1NN=C([C@H]2C[C@@H]12)c1ccc(OC2CCN(CC2)C2CCC2)cc1 |r,c:3|
O=C1NN=C(C2CC12)c1ccc(OC2CCN(CC2)C2CCC2)cc1 |c:3|
O=C(OCc1ccccc1)N1Cc2ccc(cc2C1)N1CCN(CC1)C1CCCC1
CC(=C)CN1CCN(CC1)c1ccc2CN(Cc2c1)C(=O)OCc1ccccc1
CC(=C)CN1CCN(CC1)c1ccc2CCN(Cc2c1)C(=O)OCc1ccccc1
CN1CCN(CC1)c1ccc2CN(Cc2c1)C(=O)OCc1ccccc1
CCOC(=O)CCN1CCN(CC1)c1ccc2CN(Cc2c1)C(=O)OCc1ccccc1
O=C(OCc1ccccc1)N1CCc2ccc(cc2C1)N1CCN(CC1)C1CCCC1
COC1=CC2(C=C(OC)C1=O)N(C(C(=O)NC1CCCCC1)c1ccc(OC)c(OC)c1OC)C(=O)C(=C2c1ccccc1)c1ccc(cc1)C(F)(F)F |c:39,t:2,5|
COc1ccc(NC2(C(=O)N(C(=O)C2=Cc2ccccc2)C(C)(C)C)c2ccc(F)cc2)cc1
COc1cc(cc(OC)c1OC)N1C(=O)\C(=C/c2ccccc2)C1(C(=O)NC(C)(C)C)c1ccc(Cl)c(F)c1
COc1ccc(cc1OC)N1C(=O)\C(=C/c2ccccc2)C1(C(=O)NC(C)(C)C)c1ccc(Br)cc1
COc1ccc(NC2(C(=O)N(C(=O)C2=Cc2ccccc2)C(C)(C)C)c2ccccc2)cc1
COc1ccc(cc1)C1=C(c2ccccc2)C2(C=CC(=O)C=C2)N(C(C(=O)NC2CCCCC2)c2cc3OCOc3cc2Br)C1=O |c:9,19,23|
[H][C@@]12CC(=O)C=C[C@]11N([C@@H](C(=O)N2)c2cc(F)cc(F)c2)C(=O)C=C1c1ccccc1 |r,c:5,26|
COc1cc(NC2(C(=O)N(C(=O)C2=Cc2ccccc2)C(C)(C)C)c2ccccc2Cl)cc(OC)c1OC
[H][C@@]12CC(=O)C=C[C@]11N([C@@H](C(=O)N2)c2ccc(cc2)[N+]([O-])=O)C(=O)C=C1c1ccccc1 |r,c:5,27|
COc1ccc(NC2(C(=O)N(C3CCCCC3)C(=O)C2=Cc2ccccc2)c2cc(F)cc(F)c2)cc1
COc1ccc(NC2(C(=O)N(C(=O)C2=Cc2ccccc2)C(C)(C)C)c2ccc(Br)cc2)cc1OC
COc1ccc(C(N2C(=O)C(=C(c3ccccc3)C22C=CC(=O)C=C2)c2ccc(cc2)C(F)(F)F)C(=O)NC2CCCCC2)c(OC)c1OC |c:21,25,t:10|
Clc1ccc(cc1)C(N1C(=O)C=C(c2ccccc2)C11C=CC(=O)C=C1)C(=O)NC1CCCCC1 |c:23,27,t:12|
[H][C@@]12CC(=O)C=C[C@]11N([C@@H](C(=O)N2)c2ccc(cc2)C(F)(F)F)C(=O)C=C1c1ccccc1 |r,c:5,28|
COc1cc(cc(OC)c1OC)N1C(=O)\C(=C/c2ccccc2)C1(C(=O)NC(C)(C)C)c1cc(F)cc(F)c1
COc1ccc(cc1)N1C(=O)\C(=C/c2ccccc2)C1(C(=O)NC1CCCCC1)c1cc(F)c(F)c(F)c1
COc1cc(cc(OC)c1OC)N1C(=O)\C(=C/c2ccccc2)C1(C(=O)NC1CCCCC1)c1ccc(F)cc1
COc1cc(NC2(C(=O)N(C(=O)C2=Cc2ccccc2)C(C)(C)C)c2ccc(Br)cc2)cc(OC)c1OC
COc1cc(NC2(C(=O)N(C(=O)C2=Cc2ccccc2)C(C)(C)C)c2cccc(Cl)c2)cc(OC)c1OC
NC(=N)SCCc1c[nH]cn1
COc1cc(cc(OC)c1OC)N1C(=O)\C(=C/c2ccccc2)C1(C(=O)NC(C)(C)C)c1ccccc1
COc1ccc(NC2(C(=O)N(C3CCCCC3)C(=O)C2=Cc2ccccc2)c2cccc(Cl)c2)cc1OC
CC(C)(C)c1ccc(OCCCCN2CCN(CC2)c2cnccn2)cc1
CCC(C)(C)c1ccc(OCCCCN2CCN(CC2)c2cccnc2)cc1
CC(C)(C)c1ccc(OCCCN2CCN(CC2)C2CCCO2)cc1
CCC(C)(C)c1ccc(OCCCN2CCN(CC2)c2cnccn2)cc1
CC(C)(C)c1ccc(OCCCN2CCN(CC2)c2cccnc2)cc1
CC(C)(C)c1ccc(OCCCCN2CCN(CC2)c2ccccn2)cc1
CC(C)(C)c1ccc(OCCCCN2CCN(CC2)c2ncccn2)cc1
CCC(C)(C)c1ccc(OCCCN2CCN(CC2)c2ccncc2)cc1
CCC(C)(C)c1ccc(OCCCCN2CCN(CC2)c2ccccn2)cc1
CCC(C)(C)c1ccc(OCCCCN2CCN(CC2)C2CCCO2)cc1
CC(C)(C)c1ccc(OCCCN2CCN(CC2)c2ncccn2)cc1
CC(C)(C)c1ccc(OCCCN2CCN(CC2)c2ccncc2)cc1
CC(C)(C)c1ccc(OCCCN2CCN(CC2)c2ccccn2)cc1
CCC(C)(C)c1ccc(OCCCN2CCCCC2)cc1
CC(C)(C)c1ccc(OCCCN2CCCCC2)cc1
CC(C)(C)c1ccc(OCCCN2CCN(CC2)c2cnccn2)cc1
CC(C)(C)c1ccc(OCCCCN2CCN(CC2)c2cccnc2)cc1
CC(C)(C)c1ccc(OCCCCN2CCN(CC2)c2ccncc2)cc1
CC(C)(C)c1ccc(OCCCCN2CCN(CC2)C2CCCO2)cc1
CCC(C)(C)c1ccc(OCCCN2CCN(CC2)c2ccccn2)cc1
CCC(C)(C)c1ccc(OCCCN2CCN(CC2)c2cccnc2)cc1
CCC(C)(C)c1ccc(OCCCN2CCN(CC2)c2ncccn2)cc1
CCC(C)(C)c1ccc(OCCCN2CCN(CC2)C2CCCO2)cc1
CCC(C)(C)c1ccc(OCCCCN2CCN(CC2)c2ccncc2)cc1
CCC(C)(C)c1ccc(OCCCCN2CCN(CC2)c2ncccn2)cc1
CCC(C)(C)c1ccc(OCCCCN2CCN(CC2)c2cnccn2)cc1
CCc1nn2c(C)cc(C)nc2c1Cc1ccc(cc1)-c1nnc(o1)C1CCNCC1
CCc1nn2c(C)cc(C)nc2c1Cc1ccc(\C=C\CN2CCNC(=O)C2)cc1
CCc1nn2c(C)cc(C)nc2c1Cc1ccc(\C=C\CN2CCNCC2=O)cc1
CCc1nn2c(C)cc(C)nc2c1Cc1ccc(CCC(=O)N2CCNCC2)cc1
CCc1nn2c(C)cc(C)nc2c1Cc1ccc(\C=C\CN2CCN(C[C@@H](O)CO)CC2)cc1 |r|
CCc1nn2c(C)cc(C)nc2c1Cc1ccc(CCCC2(O)CCNCC2)cc1
CCc1nn2c(C)cc(C)nc2c1Cc1ccc(CCCC2(O)CCN(CC2)C(C)C)cc1
CCc1nn2c(C)cc(C)nc2c1Cc1ccc(CCCN2CCN(CC2)C(C)C)cc1
CCc1nn2c(C)cc(C)nc2c1Cc1ccc(\C=C\CN2CCN(CC2)C(C)C)cc1
CCc1nc2c(C)cc(C)nn2c1Cc1ccc(\C=C\CN2CCN(CC2)C(C)C)cc1
CC(C)(C)OC(=O)NCCCCCCn1cc(CCCCN2CCC(CC2)c2ccc(cc2)-c2cc(cc3cc(ccc23)-c2ccc(cc2)C(F)(F)F)C(O)=O)nn1
CCC(C)(C)c1ccc(OCCCCCCN2CCCCC2)cc1
CCC(C)(C)c1ccc(OCCCCN2CCCCC2)cc1
CCC(C)(C)c1ccc(OCCCCN2CCCCCC2)cc1
CCC(C)(C)c1ccc(OCCCCN2CCC(C)CC2)cc1
CCC(C)(C)c1ccc(OCCCCN2CCCC(C)C2)cc1
CCC(C)(C)c1ccc(OCCCCCCCN2CCCC(C)C2)cc1
CCC(C)(C)c1ccc(OCCCCCN2CCCC(C)C2)cc1
CCC(C)(C)c1ccc(OCCCCCCCN2CCCCCC2)cc1
CCC(C)(C)c1ccc(OCCCCCCCCN2CCCCC2)cc1
CCC(C)(C)c1ccc(OCCCCCCCCN2CCCC(C)C2)cc1
CCC(C)(C)c1ccc(OCCCCCN2CCC(C)CC2)cc1
CCC(C)(C)c1ccc(OCCCCCN2CCCCCC2)cc1
CCC(C)(C)c1ccc(OCCCCCCN2CCCC(C)C2)cc1
CCC(C)(C)c1ccc(OCCCCCCCN2CCCCC2)cc1
CCC(C)(C)c1ccc(OCCCCCCCCN2CCCCCC2)cc1
CCC(C)(C)c1ccc(OCCCCCN2CCCCC2)cc1
CCC(C)(C)c1ccc(OCCCCCCN2CCC(C)CC2)cc1
CCC(C)(C)c1ccc(OCCCCCCN2CCCCCC2)cc1
CCC(C)(C)c1ccc(OCCCCCCCN2CCC(C)CC2)cc1
CCC(C)(C)c1ccc(OCCCCCCCCN2CCC(C)CC2)cc1
COc1cc(Nc2nnc(CCN3CCCCC3)o2)cc(OC)c1
CN1CCC(COc2nc(sc2C)-c2ccccc2)CC1
Cc1sc(nc1OC(=O)N1CCC(CC1)N1CCCCC1)-c1ccc(cc1)C#N
Cc1sc(nc1OCCCN1CCCCC1)-c1ccncc1
CCc1sc(nc1OCCCN1CCCCC1)-c1ccccc1
C(Cc1nnc(Nc2ccccc2)o1)N1CCCCC1
C[C@@H]1CCCN1CCCOc1ccc(cc1)-c1nc(C)c(s1)C(=O)N1CCOCC1 |r|
CN(C)CCCc1nnc(Nc2ccccc2)o1
CN1CCC(CC1)c1nnc(Nc2ccc(Cl)cc2)o1
COc1ccc(Nc2nnc(CCN3CCCCC3)o2)cc1
CCN(CC)CCCNC(=O)c1nc(no1)-c1ccc(OC)cc1
Cc1sc(nc1OCCCN1CCCCC1)-c1ccccc1
Cc1sc(nc1OCCN1CCCC1)-c1ccc(Cl)cc1
Cc1sc(nc1OCCCN1CCCCC1)-c1ccc(cc1)C#N
Cc1sc(nc1OCCCN1CCCCC1)-c1cccc(Cl)c1
Cc1sc(nc1OCCCN1CCCC1)-c1ccncc1
Cc1sc(nc1OCCCN1CCCCC1)-c1ccc2C(=O)OCc2c1
Cc1sc(nc1OCc1ccc(CN2CCCC2)cc1)-c1cnccn1
CCCN1CCN(CC1)c1ncc(CCN(C)CCCc2ccccc2)s1
C(CN1CCCCC1)Cc1nnc(Nc2ccccc2)o1
CN(C)CCCc1nnc(Nc2ccc(Cl)cc2)o1
Clc1ccc(Nc2nnc(CCN3CCCCC3)o2)cc1
COc1ccc(Nc2nnc(CN(C)C)o2)cc1
COc1ccc(Nc2nnc(o2)C2CCN(C)CC2)cc1
COc1cc(Nc2nnc(CN(C)C)o2)cc(OC)c1
CCN(CC)CCCNC(=O)c1nc(no1)-c1ccccc1
CN(C)CCCOc1nc(sc1C)-c1ccccc1
Cc1sc(nc1OCCN1CCCC1)-c1ccccc1
Cc1sc(nc1OCCN1CCCCC1)-c1ccccc1
CN1CCN(CC1)C(=O)Oc1nc(sc1C)-c1ccccc1
Cc1sc(nc1OC(=O)N1CCC(CC1)N1CCCCC1)-c1ccccc1
Cc1sc(nc1OCCN1CCCCC1)-c1ccc(Cl)cc1
Cc1sc(nc1OC(=O)N1CCC(CC1)N1CCCCC1)-c1ccc(Cl)cc1
Cc1sc(nc1OCCN1CCCC1)-c1ccc(cc1)C#N
Cc1sc(nc1OCCN1CCCCC1)-c1cccc(Cl)c1
Cc1sc(nc1OCCCN1CCCC1)-c1cccc(Cl)c1
CN(C)CCCOc1nc(sc1C)-c1ccncc1
Cc1sc(nc1OCCN1CCCC1)-c1ccncc1
Cc1sc(nc1OCCN1CCCCC1)-c1ccncc1
Cc1sc(nc1OCCN1CCCC1)-c1cnccn1
Cc1sc(nc1OCCCN1CCCCC1)-c1cnccn1
Cc1sc(nc1OCc1ccc(CN2CCCCC2)cc1)-c1ccc(cc1)C#N
Cc1sc(nc1OCc1ccc(CN2CCCC2)cc1)-c1ccc(cc1)C#N
Cc1sc(nc1OCc1ccc(CN2CCCCC2)cc1)-c1cnccn1
CCc1sc(nc1OCCCN1CCCC1)-c1ccc(Cl)cc1
CN1CCC(CC1)c1nnc(Nc2ccccc2)o1
Cc1sc(nc1OCCCN1CCCC1)-c1ccccc1
Cc1sc(nc1OCCCN1CCCC1)-c1ccc(Cl)cc1
Cc1sc(nc1OC(=O)N1CCC(CC1)N1CCCCC1)-c1cccc(Cl)c1
CCc1sc(nc1OCCCN1CCCCC1)-c1ccc(Cl)cc1
CN(C)CCCOc1nc(sc1C)-c1ccc(Cl)cc1
FC(F)(F)Oc1ccc(Nc2nnc(CCN3CCCCC3)o2)cc1
CN1CCN(CC1)C(=O)Oc1nc(sc1C)-c1cnccn1
O=C(NCCCN1CCCCC1)c1nc(no1)-c1ccccc1
Cc1sc(nc1OCCCN1CCCCC1)-c1ccc(Cl)cc1
CN(C)CCCOc1nc(sc1C)-c1cnccn1
Clc1ccc(Cc2noc(CCN3CCCCC3)n2)cc1
Clc1nc(N2CCC(CC2)N2CCCCC2)c2ccn(Cc3ccc4ccccc4c3)c2n1
Clc1nc(N2CCC(CC2)N2CCCCC2)c2ccn(Cc3ccccc3)c2n1
Clc1nc(N2CCC(CC2)N2CCCCC2)c2ccn(Cc3cccc4ccccc34)c2n1
Clc1nc(N2CCC(CC2)N2CCOCC2)c2ccn(Cc3ccccc3)c2n1
Fc1ccc2c(noc2c1)C1CCN(CCCCC(=O)c2cc3CCN4c3c(CCC4=O)c2)CC1
[H]C12CCC([H])(CC(C1)NC(=O)c1cc(Cl)c(N)cc1OC)N2C
COc1nc(N)c(Cl)cc1C(=O)NC1CC2CCC(C1)N2C |TLB:21:20:13.19.14:16.17,12:13:20:16.17|
COc1nc(N)c(Cl)cc1C(=O)NC1CC2CCCC(C1)N2C |TLB:22:21:13.20.14:16.18.17,12:13:21:16.18.17|
[H][C@@]1(C[C@]1([H])c1c[nH]cn1)NC(=O)[C@@H](N)Cc1ccccc1
[H][C@]1(C[C@@]1([H])c1c[nH]cn1)\C=C\[C@@H](N)CC1CCCCC1
Ic1ccc(COCCCc2c[nH]cn2)cc1
N[C@H](COCc1ccc(Br)cc1)Cc1c[nH]cn1
[H][C@]1(C[C@@]1([H])c1c[nH]cn1)\C=C/[C@@H](N)CC1CCCCC1
N[C@H](COCc1ccccc1)Cc1c[nH]cn1
COC[C@@H](N)Cc1c[nH]cn1
N[C@H](CO)Cc1c[nH]cn1
N[C@@H](COCc1ccc(I)cc1)Cc1c[nH]cn1
C(COCc1ccccc1)Cc1c[nH]cn1
N[C@@H](Cc1ccccc1)C(=O)NCCc1c[nH]cn1
N[C@@H](CO)Cc1c[nH]cn1
N[C@@H](COCc1ccccc1)Cc1c[nH]cn1
N[C@H](Cc1ccccc1)C(=O)NCCc1c[nH]cn1
N[C@H](COCC1CCCCC1)Cc1c[nH]cn1
N[C@H](COCc1ccc(I)cc1)Cc1c[nH]cn1
N[C@@H](COCc1ccc(Br)cc1)Cc1c[nH]cn1
C[C@H](N)Cc1c[nH]cn1
N[C@@H](COCC1CCCCC1)Cc1c[nH]cn1
NC[C@@H]1O[C@@H](C=C1)c1c[nH]cn1 |c:5|
C(OCc1ccccc1)[C@@H]1CC[C@H](O1)c1c[nH]cn1
NC[C@H]1CC[C@@H](O1)c1c[nH]cn1
C\N=C(\NC[C@@H]1CC[C@H](O1)c1c[nH]cn1)NC#N
NC[C@H]1CC[C@H](O1)c1c[nH]cn1
NC[C@H]1O[C@H](C=C1)c1c[nH]cn1 |c:5|
NC[C@H]1O[C@@H](C=C1)c1c[nH]cn1 |c:5|
NC[C@@H]1O[C@H](C=C1)c1c[nH]cn1 |c:5|
CC(CN)c1cnc[nH]1
C(OCc1ccccc1)[C@H]1CC[C@@H](O1)c1c[nH]cn1
C\N=C(\NC[C@H]1CC[C@H](O1)c1c[nH]cn1)NC#N
C(OCc1ccccc1)[C@@H]1CC[C@@H](O1)c1c[nH]cn1
C\N=C(\NC[C@@H]1CC[C@@H](O1)c1c[nH]cn1)NC#N
NC[C@@H]1CC[C@H](O1)c1c[nH]cn1
C(OCc1ccccc1)[C@H]1CC[C@H](O1)c1c[nH]cn1 |r|
NC[C@@H]1CC[C@@H](O1)c1c[nH]cn1
C1CC(CCN1)c1c[nH]cn1
C1CC(CCN1)=Cc1c[nH]cn1 |(1.48,1.21,;-.04,1.44,;-.6,2.89,;.37,4.08,;1.9,3.85,;2.46,2.41,;-2.12,3.13,;-3.09,1.91,;-4.62,1.98,;-5.16,.53,;-3.97,-.4,;-2.68,.46,)|
NCCCCCCc1cnc[nH]1
NCCCCCc1c[nH]cn1
NCC1CC1c1c[nH]cn1
C1CC(=CCN1)c1c[nH]cn1 |c:2|
O=C(C1CCNCC1)c1c[nH]cn1
C=C(C1CCNCC1)c1c[nH]cn1
[H][C@]1(Cc2c[nH]cn2)CCNC1
C(C1CCNC1)c1c[nH]cn1
[H][C@@]1(Cc2c[nH]cn2)CCNC1
C(CC1CCCCN1)Cc1c[nH]cn1
C(Cc1c[nH]cn1)C1CCCCN1
NCCCc1c[nH]cn1
C(C1CCCCN1)c1c[nH]cn1
C(C1CCN(Cc2ccccc2)CC1)c1c[nH]cn1
CN1CCC(CC1)=Cc1c[nH]cn1 |(4.77,1,;3.23,.97,;2.48,-.36,;.94,-.38,;.15,.95,;.89,2.26,;2.46,2.3,;-1.39,.97,;-2.19,-.33,;-3.68,-.63,;-3.87,-2.17,;-2.49,-2.81,;-1.44,-1.69,)|
C(Cc1c[nH]cn1)C1CCN(CCc2ccccc2)CC1
CN1CCC(CCc2c[nH]cn2)CC1
CC(C)N1CCC(CCc2c[nH]cn2)CC1
CC(C)N1CCC(CC1)=Cc1c[nH]cn1 |(4.85,-.29,;4.02,1,;4.71,2.35,;2.46,.93,;1.76,-.44,;.22,-.51,;-.6,.79,;.09,2.14,;1.64,2.24,;-2.17,.76,;-2.91,-.57,;-4.39,-.92,;-4.53,-2.46,;-3.12,-3.06,;-2.1,-1.9,)|
CCN1CCC(CC1)=Cc1c[nH]cn1 |(5.08,1,;3.98,2.07,;2.5,1.67,;2.1,.19,;.61,-.22,;-.48,.88,;-.09,2.35,;1.43,2.77,;-1.99,.53,;-2.43,-.94,;-3.79,-1.6,;-3.59,-3.14,;-2.1,-3.42,;-1.36,-2.06,)|
CN1CCC(Cc2c[nH]cn2)CC1
C(Cc1c[nH]cn1)C1CCN(CC1)C1CCCCC1
C1CCC(CC1)N1CCC(CC1)=Cc1c[nH]cn1 |(6,.63,;5.26,1.95,;3.72,1.98,;2.95,.68,;3.67,-.66,;5.21,-.7,;1.41,.68,;.61,-.63,;-.9,-.63,;-1.67,.72,;-.88,2.05,;.66,2.02,;-3.23,.75,;-4.03,-.56,;-5.54,-.86,;-5.73,-2.39,;-4.35,-3.04,;-3.29,-1.92,)|
CCN1CCC(CCc2c[nH]cn2)CC1
C(Cc1ccccc1)N1CCC(Cc2c[nH]cn2)CC1
C(Cc1c[nH]cn1)C1CCN(Cc2ccccc2)CC1
C(C1CCN(CC1)C1CCCCC1)c1c[nH]cn1
C(N1CCC(CC1)=Cc1c[nH]cn1)c1ccccc1 |(-2.57,1.25,;-1.24,.48,;-1.24,-1.06,;.09,-1.83,;1.43,-1.06,;1.43,.48,;.09,1.25,;2.78,-1.85,;2.78,-3.39,;1.62,-4.44,;2.24,-5.82,;3.78,-5.68,;4.09,-4.16,;-2.57,2.79,;-1.23,3.56,;-1.23,5.1,;-2.57,5.87,;-3.9,5.1,;-3.9,3.56,)|
C(Cc1ccccc1)N1CCC(CC1)=Cc1c[nH]cn1 |(1.75,.79,;3.05,-.03,;4.42,.67,;5.67,-.16,;7.05,.53,;7.14,2.08,;5.86,2.91,;4.48,2.21,;.4,.04,;.36,-1.49,;-1.02,-2.22,;-2.32,-1.41,;-2.28,.14,;-.9,.86,;-3.68,-2.12,;-4.97,-1.34,;-6.46,-1.78,;-7.32,-.49,;-6.39,.72,;-4.96,.19,)|
CC(C)N1CCC(Cc2c[nH]cn2)CC1
CCN1CCC(Cc2c[nH]cn2)CC1
C(CN1CCC(Cc2c[nH]cn2)CC1)Cc1ccccc1
C(N1CCCCC1)c1ccc(CN2CCCCC2)cc1
NCc1ccc(cc1)-c1ccc(CN)cc1
NC(=N)NCCSC(N)=N
Clc1ccc(CNC(=N)SCCCCc2c[nH]cn2)cc1
CN1CCC(CC1)C(=N\O)\c1cc2ccccc2[nH]1
N=C(NCCCc1c[nH]cn1)NC(=O)CCc1ccccc1
NC(=N)SCCc1c[nH]cn1
CN1CCN(CC1)C(=N/O)\c1cc2cc(Cl)ccc2[nH]1
NC(=N)SCCCc1c[nH]cn1
CN1CCC(CC1)C(=N\O)\c1nc2cc(Cl)ccc2[nH]1
CN1CCC(CC1)C(=N\O)\c1cc2cc(C)ccc2[nH]1
COC(=O)CCCCCN1CCC(CNC(=O)c2c3OCCCn3c3ccccc23)CC1
OC(=O)CCCCCN1CCC(CNC(=O)c2c3OCCCn3c3ccccc23)CC1
CN\C(NCCCc1c[nH]cn1)=N/C#N
C\N=C(/S)NCCCCc1c[nH]cn1
C(COc1ccc(CCCc2ccc(OCCCN3CCCCC3)cc2)cc1)CN1CCCCC1
O=C(CCc1ccc(OCCCN2CCCCC2)cc1)c1ccc(OCCCN2CCCCC2)cc1
C(COc1ccc(cc1)-c1cccc(CN2CCCCC2)c1)CN1CCCCC1
C(COc1ccc(cc1)-c1ccc(CCCN2CCCCC2)cc1)CN1CCCCC1
C(COc1ccc(cc1)-c1ccc(\C=C\CN2CCCCC2)cc1)CN1CCCCC1
C(COc1ccc(cc1)-c1ccc(CN2CCCCC2)cc1)CN1CCCCC1
C(CCN1CCCCC1)COc1ccc(cc1)-c1ccc(OCCCN2CCCCC2)cc1
O=C(\C=C\c1ccc(OCCCN2CCCCC2)cc1)c1ccc(OCCCN2CCCCC2)cc1
C(COc1ccc(Cc2ccc(OCCCN3CCCCC3)cc2)cc1)CN1CCCCC1
N#C\[#6](C#N)=[#6]-1\[#7](-[#6]-[#6]-[#6]-[#6]-[#7]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#6]-[#6]-[#6]-1
FC1(F)CCN(CCCOc2ccc(cc2)-c2ccc(OCCCN3CCCCC3)cc2)CC1
C(COc1ccc(cc1)-c1ccc(cc1)C#CCN1CCCCC1)CN1CCCCC1
C(COc1ccc(CCc2ccc(OCCCN3CCCCC3)cc2)cc1)CN1CCCCC1
N#C\[#6](C#N)=[#6]-1/[#7](-[#6]-[#6]-[#6]-[#6]-[#7]-2-[#6]-[#6]-[#6]-[#6]-[#6]-2)-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#6]-[#7]-1-[#6]-[#6]-[#6]-[#6]-[#6]-1
CN1CCN(CC1)c1ccc(cc1)-c1ccc(OCCCN2CCCCC2)cc1
C(COc1ccc(cc1)-c1ccc(\C=C/CN2CCCCC2)cc1)CN1CCCCC1
C(COc1ccc(cc1)-c1ccc(OCCN2CCCCC2)cc1)CN1CCCCC1
C(COc1ccc(cc1)-c1ccc(OCCCN2CCCCC2)cc1)CN1CCCCC1
C(COc1ccc(cc1)-c1ccccc1CN1CCCCC1)CN1CCCCC1
O=C(NCCCCOc1ccccc1)OCCCc1c[nH]cn1
O=C(NCCCCC1CCCCC1)OCCCc1c[nH]cn1
CCC\C=C\CNC(=O)OCCCc1c[nH]cn1
C=CCCCNC(=O)OCCCc1c[nH]cn1
O=C(NCCC1CC1)OCCCc1c[nH]cn1
O=C(NCCC1CCCCC1)OCCCc1c[nH]cn1
CC\C=C\CCNC(=O)OCCCc1c[nH]cn1
Clc1ccc(CCNC(=O)OCCCc2c[nH]cn2)cc1
O=C(NCCCC1CCCCC1)OCCCc1c[nH]cn1
O=C(NCCCOc1ccccc1)OCCCc1c[nH]cn1
CCC(C)CCNC(=O)OCCCc1c[nH]cn1
Clc1ccccc1OCCNC(=O)OCCCc1c[nH]cn1
C=CCCNC(=O)OCCCc1c[nH]cn1
O=C(CCc1c[nH]c2ccccc12)Nc1ccc(CN2CCCCC2)cc1
C(Cc1c[nH]c2ccccc12)Nc1ccc(CN2CCOCC2)cc1
O=C(CCc1c[nH]c2ccccc12)Oc1ccc(CN2CCCC2)cc1
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(CN2CCCC2)cc1
O=C(Nc1ccc(CN2CCCCC2)cc1)c1c[nH]c2ccccc12
O=C(Cc1c[nH]c2ccccc12)Oc1ccc(CN2CCOCC2)cc1
O=C(Oc1ccc(CN2CCCCC2)cc1)c1c[nH]c2ccccc12
CCN(CC)Cc1ccc(NCCc2c[nH]c3ccccc23)cc1
C(Cc1c[nH]c2ccccc12)Nc1ccc(CN2CCCCC2)cc1
CCN(CC)Cc1ccc(NC(=O)CCc2c[nH]c3ccccc23)cc1
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(CN2CCCCC2)cc1
O=C(Cc1c[nH]c2ccccc12)Nc1ccc(CN2CCOCC2)cc1
O=C(Cc1c[nH]c2ccccc12)Oc1ccc(CN2CCCCC2)cc1
O=C(CCc1c[nH]c2ccccc12)Nc1ccc(CN2CCCC2)cc1
O=C(CCc1c[nH]c2ccccc12)Oc1ccc(CN2CCOCC2)cc1
O=C(CCc1c[nH]c2ccccc12)Oc1ccc(CN2CCCCC2)cc1
O=C(Cc1c[nH]c2ccccc12)Oc1ccc(CN2CCCC2)cc1
C(CNc1ccc(CN2CCOCC2)cc1)Cc1c[nH]c2ccccc12
C(Nc1ccc(CN2CCCCC2)cc1)c1c[nH]c2ccccc12
CCN(CC)Cc1ccc(OC(=O)Cc2c[nH]c3ccccc23)cc1
C(Cc1c[nH]c2ccccc12)Nc1ccc(CN2CCCC2)cc1
O=C(CCc1c[nH]c2ccccc12)Nc1ccc(CN2CCOCC2)cc1
CCN(CC)Cc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1
CCN(CC)Cc1ccc(OC(=O)CCc2c[nH]c3ccccc23)cc1
Clc1ccc(CCCCC(=O)NCCCN2CCCCC2)cc1
FC(F)(F)c1ccc(CCCCNC(=N)SCCCN2CCCCC2)cc1
Clc1ccc(CCNC(=N)SCCCN2CCOCC2)cc1
FC(F)(F)c1ccc(CCCCNC(=O)CCCN2CCCCC2)cc1
Clc1ccc(CCCCNC(=O)CCCN2CCCCC2)cc1
N=C(NCCCCCc1ccccc1)SCCCN1CCCCC1
Clc1ccc(CCCNC(=N)SCCCN2CCCCC2)cc1
Clc1ccc(CNC(=N)SCCCN2CCNCC2)cc1
CN1CCN(CCCSC(=N)NCc2ccc(Cl)cc2)CC1
Clc1ccc(CNC(=N)SCCCN2CCCC2)cc1
N=C(NCCCCc1ccc(cc1)C#N)SCCCN1CCCCC1
Clc1ccc(CCCCNC(=N)SCCCN2CCCCC2)cc1
N=C(NCCCCN1CCCCC1)SCCCN1CCCCC1
Clc1ccc(CCNC(=N)SCCCN2CCCC2)cc1
Clc1ccc(CNC(=N)SCCCN2CCOCC2)cc1
Clc1ccc(CCNC(=N)SCCCN2CCCCC2)cc1
Clc1ccc(CNC(=N)SCCCN2CCCCC2)cc1
CC(C)N1CCN(CC1)C(=O)[C@@H]1CC11CCN(CC1)C1CCOCC1 |r|
CC(C)N1CCN(CC1)C(=O)N1CC2(C1)CCN(CC2)C1CCOCC1
CC(C)N1CCC2(CC2C(=O)N2CCN(CC2)C2CCCCC2)CC1
CC(C)N1CCN(CC1)C(=O)C1CC2(C1)CCN(CC2)C1CCOCC1
O=C(C1CC11CCC(CC1)C1CCCCC1)N1CCN(CC1)C1CCC1 |(67.67,-30.09,;68.4,-31.45,;67.59,-32.76,;67.54,-34.3,;66.23,-33.49,;65.44,-32.17,;63.9,-32.18,;63.15,-33.52,;63.93,-34.84,;65.47,-34.83,;61.61,-33.53,;60.82,-32.2,;59.29,-32.21,;58.52,-33.55,;59.3,-34.88,;60.85,-34.87,;69.94,-31.5,;70.66,-32.86,;72.2,-32.91,;73.01,-31.6,;72.28,-30.24,;70.74,-30.19,;74.55,-31.65,;75.59,-32.78,;76.72,-31.72,;75.67,-30.6,)|
O=C(C1CC11CCN(CC1)c1ccncc1)N1CCN(CC1)C1CCCCC1
O=C(C1CC11CCN(CCc2ccccc2)CC1)N1CCN(CC1)C1CCCCC1
O=C(C1CC11CCNCC1)N1CCN(CC1)C1CCCCC1
O=C(C1CC11CCN(CC1)C1CCC1)N1CCN(CC1)C1CCOCC1
O=C(C1CC11CCN(CC1)C1CCOCC1)N1CCN(CC1)C1CCCCCC1
O=C(C1CC11CCN(CC1)C1CCOCC1)N1CCN(CC1)C1CCCCC1
O=C(C1CC11CCN(CC1)C1CCOCC1)N1CCN(CC1)C1CCCC1
CC(C)N1CCN(CC1)C(=O)C1CC11CCN(CC1)C1CCOCC1
O=C(N1CCCC2(CCN(CC2)C(=O)c2ccccc2)C1)N1CCCN(CC1)C1CCC1
O=C(N1CCC2(C1)CCN(CC2)S(=O)(=O)c1ccccc1)N1CCN(CC1)C1CCC1
O=C(N1CCC2(C1)CCN(CC2)S(=O)(=O)c1ccccc1)N1CCCN(CC1)C1CCC1
O=C(N1CCC2(C1)CCCN(C2)C(=O)c1ccccc1)N1CCCN(CC1)C1CCC1
O=C(C1CC2(C1)CCN(CC2)C(=O)c1ccccc1)N1CCN(CC1)C1CCC1
CS(=O)(=O)N1CCC2(CC(C2)C(=O)N2CCN(CC2)C2CCC2)CC1
CC(C)N1CCN(CC1)C(=O)N1CCC2(C1)CCN(CC2)C1CCOCC1
CC(C)N1CCN(CC1)C(=O)N1CCC2(C1)CCCN(C2)C1CCOCC1
O=C(C1CC11CCN(Cc2ccccc2)CC1)N1CCN(CC1)C1CCCCC1
CC(C)N1CCCN(CC1)C(=O)C1CC2(C1)CCN(CC2)C(=O)c1ccccc1
CC(C)N1CCN(CC1)C(=O)[C@H]1CC11CCN(CC1)C1CCOCC1 |r|
O=C(C1CC11CCN(CC1)C1CCOCC1)N1CCN(CC1)c1ccncc1
CN1CCN(CC1)C(=O)C1CC11CCN(CC1)C1CCOCC1
O=C(N1CCC2(C1)CCCN(C2)S(=O)(=O)c1ccccc1)N1CCCN(CC1)C1CCC1
CC(C)N1CCCN(CC1)C(=O)C1CC2(C1)CCN(CC2)C1CCOCC1
O=C(C1CC2(C1)CCN(CC2)C1CCOCC1)N1CCN(CC1)C1CCCCC1
O=C(C1CC2(C1)CCN(CC2)C1CCOCC1)N1CCCN(CC1)C1CCC1
O=C(N1CCC2(C1)CCCN(C2)C1CCOCC1)N1CCCN(CC1)C1CCC1
O=C(C1CC2(C1)CCN(CC2)C1CCOCC1)N1CCN2CCCCC2C1
O=C(C1CC11CCN(CC1)C1CCCCC1)N1CCN(CC1)C1CCCCC1
O=C(C1CC11CCN(CC1)C1CCOCC1)N1CCCN(CC1)C1CCC1
O=C(C1CC11CCN(CC1)C1CCOCC1)N1CCN(CC1)C1CCC1
O=C(C1CC11CCN(CC1)C1CCOCC1)N1CCN(CC1)C1CC1
O=C(C1CCN(CC1)C1CCC1)N1CCC2(C1)CCN(CC2)C(=O)c1ccccc1
CC(C)S(=O)(=O)N1CCC2(CCN(C2)C(=O)N2CCCN(CC2)C2CCC2)CC1
O=C(N1CCC2(C1)CCN(CC2)C(=O)c1ccccc1)N1CCCN(CC1)C1CCC1
O=C(C1CC2(C1)CCN(CC2)C1CCOCC1)N1CCN(CC1)C1CCC1
O=C(C1CC2(C1)CCN(CC2)c1ccccc1)N1CCN(CC1)C1CCC1
O=C(C1CC11CCN(CC1)c1ccccc1)N1CCN(CC1)C1CCCCC1
O=C(N1CCC2(C1)CCN(CC2)C(=O)c1ccccc1)N1CCN(CC1)C1CCC1
CC[C@H]1c2cc(OC)ccc2CC[C@@]1(C)N |r|
CC[C@H]1c2cc(C)ccc2OC[C@@]1(C)N |r|
CC[C@H]1c2ccccc2N(C[C@@]1(C)N)c1ccccc1 |r|
CCN(CC)CCCOc1ccc(cc1)-n1ccc(=O)c(O)c1C
C([C@@H]1C[C@H]1c1c[nH]cn1)c1nc2ccccc2[nH]1 |r|
C(C[C@@H]1C[C@H]1c1c[nH]cn1)NCc1nc2ccccc2[nH]1 |r|
CN1CCN(CC1)[C@@H]1C[C@@H]1CCNCc1ccc(Cl)cc1 |r|
Clc1ccc(CNCC[C@H]2C[C@H]2N2CCNCC2)cc1 |r|
Clc1ccc(CNC[C@H]2C[C@H]2N2CCNCC2)cc1 |r|
Clc1ccc(CNCC[C@@H]2C[C@H]2c2nc3cc(Cl)ccc3[nH]2)cc1 |r|
Clc1ccc(CNC[C@@H]2C[C@@H]2c2cc3cc(Cl)ccc3[nH]2)cc1 |r|
Clc1ccc(CNC[C@@H]2C[C@H]2c2nc3cc(Cl)ccc3[nH]2)cc1 |r|
CN1CCN(CC1)[C@@H]1C[C@@H]1CNCc1ccc(Cl)cc1 |r|
Clc1ccc(CNCC[C@@H]2C[C@@H]2c2cc3cc(Cl)ccc3[nH]2)cc1 |r|
CCC(C)(C)c1ccc(OCCCN2CC(C)CC(C)C2)cc1
CCC(C)(C)c1ccc(OCCCN2CCCCC2C)cc1
CCC(C)(C)c1ccc(OCCCN2C(C)CCCC2C)cc1
CCC(C)(C)c1ccc(OCCCN2CCCC(C)(C)C2)cc1
CCC(C)(C)c1ccc(OCCCN2CCC(C)CC2)cc1
CCC(C)(C)c1ccc(OCCCN2CCCC(C)C2)cc1
CCC(C)(C)c1ccc(OCCCN2CCCCCC2)cc1
CCC(C)(C)c1ccc(OCCCN2CCCC2)cc1
Clc1ccc(OCCCCCCCN2CCCCC2)cc1
O=c1n2CCCc2nc2ccc(OCCCN3CCCCC3)cc12
CN(CC#C)Cc1cc2cc(OCCCC3CCN(Cc4ccccc4)CC3)ccc2n1C
CC(C)(C)CNc1nccc(NC2CCNCC2)n1
CC(C)(C)CNc1nccc(NCCN)n1
[3H]C([3H])([3H])N(C)[C@@H]1CCN(C1)c1ccnc(NCC(C)(C)C)n1
CC(C)(C)CNc1nccc(n1)N1CC[C@@H](N)C1
CC(C)(C)CNc1nccc(n1)N1CCNCC1
CC(C)(C)CNc1nccc(NC2CCNC2)n1
CC(C)(C)CNc1nccc(n1)N1CCc2nc[nH]c2C1
CN[C@@H]1CCN(C1)c1ccnc(NCC(C)(C)C)n1
CN(C)[C@@H]1CCN(C1)c1ccnc(NCC(C)(C)C)n1
CC(C)(C)CNc1nccc(n1)N1CCCN(CC1)C(N)=N
CCC(=O)N[C@@H]1CCN(C1)c1ccnc(NCC(C)(C)C)n1
CC(C)(C)CNc1nccc(NCCCN)n1
CC(C)(C)CNc1nccc(NCCCc2c[nH]cn2)n1
CC(C)(C)CNc1nccc(n1)N1CC[C@H](C1)NC(N)=N
CC(C)(C)CNc1nccc(NCCc2c[nH]cn2)n1
Cc1[nH]cnc1CSCCNc1ccnc(NCC(C)(C)C)n1
CN1CCCN(CC1)c1ccnc(NCC(C)(C)C)n1
CN1CCN(CC1)c1ccnc(NCC(C)(C)C)n1
CC(C)(C)CNc1nccc(n1)N1CCN(CC1)C(N)=N
CC(C)(C)CNc1nccc(n1)N1CCCNCC1
CC(C)(C)CNc1nccc(n1)N1CCN(CCN)CC1
[H][C@@]12CCC[C@]1([H])CN(CCCOc1ccc(cc1)C(N)=O)C2 |r|
CN1CCc2ccc(OCCCN3CCCC3)cc2C1=O
CC1CCCN1CCCOc1ccc2CCN(C)C(=O)c2c1
CN1CCc2ccc(OCCCN3CCOCC3)cc2C1=O
CN1CCc2ccc(OCCCN3CCC(O)CC3)cc2C1=O
CC1CCN(CCCOc2ccc3CCN(C)C(=O)c3c2)CC1
CN1CCc2ccc(OCCCN3CCCCC3)cc2C1=O
Clc1ccc(Cn2ccc3c(ncnc23)N2CCC(CC2)N2CCCCC2)cc1
Nc1nc(N2CCC(CC2)N2CCOCC2)c2ccn(CCN3CCOCC3)c2n1
Clc1nc(N2CCC(CC2)N2CCCCC2)c2ccn(CCN3CCOCC3)c2n1
Nc1nc(N2CCC(CC2)N2CCCCC2)c2ccn(CCN3CCOCC3)c2n1
Clc1ccc(Cn2ccc3c(nc(Cl)nc23)N2CCC(CC2)N2CCCCC2)cc1
Fc1ccc(Cn2ccc3c(nc(Cl)nc23)N2CCC(CC2)N2CCCCC2)cc1
Clc1nc(N2CCC(CC2)N2CCCCC2)c2ccn(Cc3ccc(cc3)C#N)c2n1
N#Cc1ccc(Cn2ccc3c(ncnc23)N2CCC(CC2)N2CCCCC2)cc1
C(Cn1ccc2c(ncnc12)N1CCC(CC1)N1CCOCC1)N1CCOCC1
Clc1cccc(Cl)c1Cn1ccc2c(ncnc12)N1CCC(CC1)N1CCCCC1
Clc1nc(N2CCC(CC2)N2CCOCC2)c2ccn(CCN3CCOCC3)c2n1
C(Cn1ccc2c(ncnc12)N1CCC(CC1)N1CCCCC1)N1CCOCC1
Fc1ccc(Cn2ccc3c(ncnc23)N2CCC(CC2)N2CCCCC2)cc1
Clc1nc(N2CCC(CC2)N2CCCCC2)c2ccn(Cc3c(Cl)cccc3Cl)c2n1
CNC1CN(C1)c1cc(nc(N)n1)C(C)C
CC(C)c1cc(nc(N)n1)N1CC(N)C1
CCCCNC1CN(C1)c1ccnc(N)n1
CNC1CN(C1)c1cc(C)nc(N)n1
Cc1cc(nc(N)n1)N1CC(N)C1
CCc1cc(nc(N)n1)N1CC(C1)NC
CCc1cc(nc(N)n1)N1CC(N)C1
CCNC1CN(C1)c1cc(nc(N)n1)C(C)C
CNC1CN(C1)c1ccnc(N)n1
CC(C)NC1CN(C1)c1ccnc(N)n1
CN(C)C1CN(C1)c1ccnc(N)n1
CCN(CC)C1CN(C1)c1ccnc(N)n1
CCc1cc(nc(N)n1)N1CC(C1)N(C)C
NC1CN(C1)c1ccnc(N)n1
CC(C)CNC1CN(C1)c1ccnc(N)n1
Nc1nccc(n1)N1CC(C1)N1CCCC1
CCCNC1CN(C1)c1ccnc(N)n1
CCNC1CN(C1)c1cc(CC)nc(N)n1
CCNC1CN(C1)c1ccnc(N)n1
[H][C@]12C[C@@]3([H])C[C@@H](C[C@H](C)N3C[C@@]1(C[C@]1(C(=O)Nc3c1cccc3C(=O)[C@H]1OC1(C)C)[C@]2(C)C=O)NC)OC(=O)CCCC |r|
CC(C)c1cc(nc(N)n1)N1CC(C1)N(C)C
CCNC1CN(C1)c1cc(C)nc(N)n1
CCC(C)NC1CN(C1)c1ccnc(N)n1
CN(C)C1CN(C1)c1cc(C)nc(N)n1
[H][C@]12C[C@@]1(CO)[C@@H](O)[C@@H](O)[C@@H]2n1cnc(n1)C(=O)OC |r|
O=C(NCCN1CCCCC1)c1ccc(OC2CCN(CC2)C2CCC2)cc1
FC1(F)CCN(CC(=O)Nc2ccc(OC3CCN(CC3)C3CCC3)cc2)CC1
FC(F)(F)c1cc(OC2CCN(CC2)C2CCC2)ccc1NC(=O)CN1CCCCC1
OCC1CN(CC(=O)Nc2ccc(OC3CCN(CC3)C3CCC3)cc2)CCO1
O=C(CN1CCOCC1)Nc1ccc(OC2CCNCC2)cc1
O=C(CN1CCOCC1)Nc1ccccc1OC1CCN(CC1)C1CCC1
O=C(CN1CCOCC1)Nc1ccc(OC2CCN(CC2)C2CCC2)cc1
CC(C)N1CCC(CC1)Oc1ccc(cc1)C(=O)NCCN1CCCCC1
CN(C)CC(=O)Nc1ccc(OC2CCN(CC2)C2CCC2)cc1
CCN(CC)CC(=O)Nc1ccc(OC2CCN(CC2)C2CCC2)cc1
O=C(CN1CCCCC1)Nc1ccc(OC2CCN(CC2)C2CCC2)cc1
O=C(CN1CCCCCC1)Nc1ccc(OC2CCN(CC2)C2CCC2)cc1
FC1CCN(CC(=O)Nc2ccc(OC3CCN(CC3)C3CCCC3)cc2)CC1
O=C(CN1CCCCC1)Nc1ccc(OC2CCN(CC2)C2CCCC2)cc1
C[C@@H]1CCCN1CC(=O)Nc1ccc(OC2CCN(CC2)C2CCC2)cc1C |r|
Cc1cc(OC2CCN(CC2)C2CCC2)ccc1NC(=O)CN1CCCCC1
FC(F)(F)c1cc(OC2CCN(CC2)C2CCC2)ccc1NC(=O)CN1CCCN(CC1)C1CCC1
CC(C)N1CCCN(CC(=O)Nc2ccc(OC3CCN(CC3)C3CCC3)cc2C(F)(F)F)CC1
CC(=O)N1CCN(CC(=O)Nc2ccc(OC3CCN(CC3)C3CCC3)cc2)CC1
O=C(Cc1ccncc1)Nc1ccc(OC2CCN(CC2)C2CCC2)cc1
OC1CCN(CC(=O)Nc2ccc(OC3CCN(CC3)C3CCC3)cc2)CC1
CC(C)N1CCC(CC1)Oc1ccc(NC(=O)CN2CCOCC2)cc1
Cc1cc(OC2CCN(CC2)C2CCC2)ccc1NC(=O)CN1CCOCC1
FC(F)(F)c1cc(OC2CCN(CC2)C2CCC2)ccc1NC(=O)CN1CCOCC1
COc1cc(OC2CCN(CC2)C2CCC2)ccc1NC(=O)CN1CCOCC1
C[C@@H]1CCCN1CC(=O)Nc1ccc(cc1)N1CCOCC1 |r|
O=C(CN1CCOCC1)Nc1ccc(CN2CCCC2)cc1
O=C(CN1CCOCC1)Nc1ccc(cc1)N1CCN(CC1)C1CCC1
CN(C(=O)CN1CCOCC1)c1ccc(OC2CCN(CC2)C2CCC2)cc1
CCN(C(=O)CN1CCOCC1)c1ccc(OC2CCN(CC2)C2CCC2)cc1
O=C(NCCN1CCCC1)c1ccc(OC2CCN(CC2)C2CCCC2)cc1
C[C@@H]1CCCN1CC(=O)Nc1ccc(OC2CCN(CC2)C2CCC2)cc1 |r|
Cc1cc(OC2CCN(CC2)C2CCC2)ccc1NC(=O)CN1CCCC1
O=C(CN1CCS(=O)(=O)CC1)Nc1ccc(OC2CCN(CC2)C2CCC2)cc1
C[C@@H]1CCCN1CC(=O)Nc1ccc(CN2CCOCC2)cc1 |r|
O=C(CN1CCOCC1)Nc1cccc(OC2CCN(CC2)C2CCC2)c1
O=C(NCCN1CCCC1)c1ccc(OC2CCN(CC2)C2CCC2)cc1
CC(C)N1CCC(CC1)Oc1ccc(NC(=O)CN2CCCCC2)cc1
OCC1CCCN1CC(=O)Nc1ccc(OC2CCN(CC2)C2CCC2)cc1
CC(C)N1CCC(CC1)Oc1ccc(cc1)C(=O)NCCN1CCCC1
O=C(CN1CCCC1)Nc1ccc(OC2CCN(CC2)C2CCC2)cc1
O=C(CN1CCCC1)Nc1ccc(OC2CCN(CC2)C2CCCC2)cc1
FC(F)(F)c1cc(OC2CCN(CC2)C2CCC2)ccc1NC(=O)CN1CCCC1
CCOC(=O)N1CCN(CC(=O)Nc2ccc(OC3CCN(CC3)C3CCC3)cc2)CC1
O=C(Cc1cccnc1)Nc1ccc(OC2CCN(CC2)C2CCC2)cc1
Fc1cc(OC2CCN(CC2)C2CCC2)ccc1NC(=O)CN1CCOCC1
Fc1cc(NC(=O)CN2CCOCC2)ccc1OC1CCN(CC1)C1CCC1
C[C@@H]1CCCN1CCc1ccc(NC(=O)CN2CCOCC2)cc1
C[C@@H]1CCCN1Cc1ccc(NC(=O)CN2CCOCC2)cc1 |r|
O=C(NCCN1CCOCC1)c1ccc(OC2CCN(CC2)C2CCC2)cc1
O=C(CN1CCOCC1)Nc1ccc(OC2CCN(CC2)C2CCCC2)cc1
CC1CCCN(CCCCCCOc2ccc3OC(CC(=O)c3c2)c2ccccc2)C1
Clc1ccccc1C(=O)N1CCN(CCCOCC2CCC2)CC1
Cc1ccc2oc(cc(=O)c2c1)-c1ccc(OCCCCCCN2CCCCCC2)cc1
CCc1ccc(OCCCCCCN2CCC(C)CC2)cc1
O=C(C1CC1)c1ccc(OCCCN2CCN(C\C=C\c3ccccc3)CC2)cc1
CCOc1ccccc1N1CCN(CCCOCCCc2ccccc2)CC1
O=C(C1CC1)c1ccc(OCCCN2CCN(CC2)c2ccccc2)cc1
CC1CCCN(CCCCCCOc2ccc(cc2)-c2cc(=O)c3cc(C)ccc3o2)C1
C(COCCCc1ccccc1)CN1CCN(Cc2ccccc2)CC1
CCc1ccc(OCCCCCCN2CCCCCC2)cc1
Cc1ccc2oc(cc(=O)c2c1)-c1ccc(OCCCCCCN2CCCCC2)cc1
C(COCCCc1ccccc1)CN1CCN(C\C=C\c2ccccc2)CC1
CCOC(=O)C1=C(C)NC(C)=C(C1c1ccc(OCCCCN2CCCC2)cc1)C(=O)OCC |c:5,10|
CCOC(=O)C1=C(C)NC(C)=C(C1c1ccc(OCCCCCN2CCCC2)cc1)C(=O)OCC |c:5,10|
CC(=O)NCCc1c[nH]c2c1cc(cc2)OC
CCOC(=O)C1=C(C)NC(C)=C(C1c1ccc(OCCCN2CCCCC2)cc1)C(=O)OCC |c:5,10|
CCOC(=O)C1=C(C)NC(C)=C(C1c1ccc(OCCCN2CCCC2)cc1)C(=O)OCC |c:5,10|
CCOC(=O)C1=C(C)NC(C)=C(C1c1ccc(OCCCN2CCCCC2)c(OCC)c1)C(=O)OCC |c:5,10|
CCOC(=O)C1=C(C)NC(C)=C(C1c1ccc(OCCCCCN2CCCCC2)cc1)C(=O)OCC |c:5,10|
CCC(=O)c1ccc(OCCCCN2CCN(CC2)c2ccccn2)cc1
CC(=O)c1ccc(OCCCCN2CCN(CC2)c2ccncc2)cc1
CC(=O)c1ccc(OCCCN2CCN(CC2)c2cnccn2)cc1
CC(=O)c1ccc(OCCCN2CCN(CC2)C2CCCO2)cc1
CC(=O)c1ccc(OCCCN2CCN(CC2)c2ccncc2)cc1
CC(=O)c1ccc(OCCCN2CCN(CC2)c2cccnc2)cc1
CC(=O)c1ccc(OCCCN2CCN(CC2)c2ccccn2)cc1
CCC(=O)c1ccc(OCCCCN2CCN(CC2)C2CCCO2)cc1
CCC(=O)c1ccc(OCCCCN2CCN(CC2)c2cnccn2)cc1
CCC(=O)c1ccc(OCCCCN2CCN(CC2)c2ncccn2)cc1
CCC(=O)c1ccc(OCCCCN2CCN(CC2)c2cccnc2)cc1
CCC(=O)c1ccc(OCCCN2CCN(CC2)C2CCCO2)cc1
CCC(=O)c1ccc(OCCCN2CCN(CC2)c2cccnc2)cc1
CCC(=O)c1ccc(OCCCN2CCN(CC2)c2ccccn2)cc1
CC(=O)c1ccc(OCCCCN2CCN(CC2)C2CCCO2)cc1
CC(=O)c1ccc(OCCCCN2CCN(CC2)c2ncccn2)cc1
CCC(=O)c1ccc(OCCCN2CCN(CC2)c2ncccn2)cc1
CC(=O)c1ccc(OCCCCN2CCN(CC2)c2cccnc2)cc1
CCC(=O)c1ccc(OCCCCN2CCN(CC2)c2ccncc2)cc1
CCC(=O)c1ccc(OCCCN2CCN(CC2)c2cnccn2)cc1
CC(=O)c1ccc(OCCCCN2CCN(CC2)c2cnccn2)cc1
CCC(=O)c1ccc(OCCCN2CCN(CC2)c2ccncc2)cc1
CC(=O)c1ccc(OCCCCN2CCN(CC2)c2ccccn2)cc1
CC(=O)c1ccc(OCCCN2CCN(CC2)c2ncccn2)cc1
CC1CCCc2c1nc(N)nc2-c1ccc(C)cc1
CC1CCCc2c1nc(N)nc2C1CCCCC1
CC1CCCc2c1nc(N)nc2-c1ccccc1
C(CN1CCCCC1)Oc1ccc(Nc2nccc(NCc3ccccc3)n2)cc1
CC1CCCc2c1nc(N)nc2-c1ccc(Cl)cc1
CC1CCCc2c1nc(N)nc2-c1ccc(F)cc1
CC1CCCc2c1nc(N)nc2-c1cccc(Br)c1
COc1cccc(c1)-c1nc(N)nc2C(C)CCCc12
CC1CCCc2c1nc(N)nc2-c1ccc(cc1)[N+]([O-])=O
CC1CCCc2c1nc(N)nc2-c1cccc(O)c1
COc1ccc(cc1)-c1nc(N)nc2CCC(C)Cc12
Cc1ccc(nc1)C1(O)CCN(CC1)c1nc(C)nc2ccsc12
CC1CCCc2c1nc(N)nc2-c1ccc(Br)cc1
CC1CCCc2c1nc(N)nc2-c1ccc(cc1)C#N
COc1ccc(cc1)-c1nc(N)nc2CCCCc12
CCCCc1cc(nc(N)n1)-c1ccc(OC)cc1
CC1CCCc2c1nc(N)nc2-c1cccnc1
COc1ccc(cc1)-c1nc(N)nc2C(C)CCCc12
CC1CCCc2c1nc(N)nc2-c1cccc2ccccc12
COc1ccccc1N1CCC2(CCN(CCCSc3nnc(-c4ccccc4)n3C)CC2)CC1
C#CCNC1CCc2cc(OCCCN3CCCCC3)ccc12
C#CCNC1CCc2ccc(OCCCN3CCCCC3)cc12
[H][C@@]12[C@@H](CC(=O)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCC[C@H]4C)cc3CC[C@@]21[H])NC(C)=O |r|
[H][C@@]12[C@H](CC(=O)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCC(F)(F)CC4)cc3CC[C@@]21[H])C(=O)NCC |r|
[H][C@@]12CC[C@H](C(=O)N3CCCC3)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCC[C@H]4C)cc3CC[C@@]21[H] |r|
[H][C@@]12CC[C@H](N3CCCC3)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCCC4)cc3CC[C@@]21[H] |r|
[H][C@@]12[C@H](CC[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCC[C@H]4C)cc3CC[C@@]21[H])C(=O)NCC |r|
[H][C@@]12[C@H](C[C@H](OC)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCC[C@H]4C)cc3CC[C@@]21[H])C(=O)NCC |r|
[H][C@@]12[C@H](CC(=O)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCC[C@@H]4C)cc3CC[C@@]21[H])C(=O)NCC |r|
[H][C@@]12[C@H](CC(=O)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CC[C@@H](F)C4)cc3CC[C@@]21[H])C(=O)NCC |r|
[H][C@@]12[C@@H](CC(=O)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCC[C@H]4C)cc3CC[C@@]21[H])C(=O)NCC |r|
[H][C@@]12[C@@H](CC(=O)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCC[C@@H]4C)cc3CC[C@@]21[H])C(=O)N1CCCC1 |r|
[H][C@@]12CC[C@H](N3CCCC3)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCCC4=O)cc3CC[C@@]21[H] |r|
[H][C@@]12[C@H](CC(=O)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCC[C@H]4C)cc3CC[C@@]21[H])C(=O)NCC |r|
[H][C@@]12[C@H](CC[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCC[C@H]4C)cc3CC[C@@]21[H])C(=O)NCC1CC1 |r|
[H][C@@]12[C@@H](CC(=O)[C@@]1(C)CC[C@]1([H])c3ccc(OCCN4CCC[C@@H]4C)cc3CC[C@@]21[H])C(=O)NCC |r|
[H][C@@]12[C@@H](CC(=O)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCC[C@@H]4C)cc3CC[C@@]21[H])C(=O)N(CC)CC |r|
[H][C@@]12[C@H](CC[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCC[C@H]4C)cc3CC[C@@]21[H])C(=O)NCC1CCC1 |r|
[H][C@@]12[C@H](CC(=O)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCC(F)CC4)cc3CC[C@@]21[H])C(=O)NCC |r|
[H][C@@]12[C@@H](CC(=O)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCCN4CCC[C@@H]4C)cc3CC[C@@]21[H])C(=O)NCC |r|
[H][C@@]12CC[C@H](N3CCCC3=O)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCC[C@H]4C)cc3CC[C@@]21[H] |r|
CCCN(CC[C@]1(O)C[C@@H](C1)NC(=O)c1ccc2ccccc2c1)[C@H]1CCc2nc(N)sc2C1 |r,wU:6.5,9.11,wD:24.26,6.6,(12.17,-57.06,;12.17,-55.52,;10.84,-54.75,;10.84,-53.21,;12.18,-52.44,;13.51,-53.21,;14.85,-52.45,;14.83,-53.98,;16.33,-52.85,;16.73,-51.37,;15.24,-50.96,;18.07,-50.6,;19.4,-51.38,;19.39,-52.92,;20.77,-50.64,;20.76,-49.1,;22.08,-48.34,;23.41,-49.1,;24.74,-48.33,;26.07,-49.11,;26.07,-50.65,;24.73,-51.41,;23.4,-50.63,;22.09,-51.39,;9.51,-52.44,;9.51,-50.9,;8.18,-50.12,;6.85,-50.89,;5.38,-50.41,;4.47,-51.66,;2.93,-51.66,;5.38,-52.92,;6.85,-52.44,;8.18,-53.2,)|
CCCN(CCC)CCCOc1ccc(cc1C)-c1cn2cccc(C)c2n1
Cc1ccn2cc(nc2c1)-c1ccc(OCCCN2CCCCCC2)cc1C
C(COc1ccc(cc1)-c1cn2CCCCc2n1)CN1CCCCC1
Clc1ccc(OCCCCCN2CCCCC2)cc1
CC1CCN(CCCCCCCOc2ccc(Cl)cc2)CC1
Clc1cccc(OCCCCCCN2CCCCCC2)c1
Clc1cccc(OCCCCCCCN2CCCCCC2)c1
CC1CCCN(CCCCCOc2ccc(Cl)cc2)C1
CC1CCCN(CCCCCCCOc2ccc(Cl)cc2)C1
CC1CCN(CCCCCOc2ccc(Cl)cc2)CC1
CC1CCN(CCCCCCOc2ccc(Cl)cc2)CC1
Clc1ccc(OCCCCCCCN2CCCCCC2)cc1
Clc1cccc(OCCCCCCN2CCCCC2)c1
CC1CCCN(CCCCCCOc2cccc(Cl)c2)C1
CC1CCCN(CCCCCCCOc2cccc(Cl)c2)C1
CC1CCN(CCCCCCCOc2cccc(Cl)c2)CC1
Clc1ccc(OCCCCCCN2CCCCC2)cc1
CC1CCCN(CCCCCCOc2ccc(Cl)cc2)C1
Clc1ccc(OCCCCCN2CCCCCC2)cc1
Clc1cccc(OCCCCCCCN2CCCCC2)c1
[H][C@]12CCN(c3ccc(cc3)-c3ccc(cc3)-n3ncccc3=O)[C@@]1([H])CN(C)C2 |r|
Clc1ccc(OCCCCCCN2CCCCCC2)cc1
CC1CCN(CCCCCCOc2cccc(Cl)c2)CC1
C(CCOc1ccc(cc1)-c1ccccc1)CCN1CCCCC1
C(CCCN1CCCCCC1)CCOc1cccc(c1)-c1ccccc1
C(CCOc1ccc(cc1)-c1ccccc1)CCN1CCCCCC1
C(CCCN1CCCCCC1)CCOc1ccc(cc1)-c1ccccc1
CC1CCN(CCCCCCOc2ccc(cc2)-c2ccccc2)CC1
C(CCCN1CCCCC1)CCOc1ccc(cc1)-c1ccccc1
CC1CCN(CCCCCOc2ccc(cc2)-c2ccccc2)CC1
CC1CCN(CCCCCCOc2cccc(c2)-c2ccccc2)CC1
CC1CCN(CCCCCOc2cccc(c2)-c2ccccc2)CC1
C(CCOc1cccc(c1)-c1ccccc1)CCN1CCCCC1
C[C@@H]1CCCN1[C@H]1C[C@@H](C1)c1ccc(cc1)-c1ccc(cc1)C#N |r,wU:8.11,1.0,wD:6.6,(34.83,-7.94,;35.15,-9.44,;34.11,-10.59,;34.88,-11.92,;36.39,-11.6,;36.55,-10.07,;37.88,-9.3,;39.37,-9.7,;39.77,-8.21,;38.28,-7.81,;41.1,-7.45,;41.1,-5.9,;42.43,-5.13,;43.77,-5.9,;43.77,-7.45,;42.43,-8.22,;45.09,-5.12,;46.43,-5.89,;47.76,-5.12,;47.75,-3.58,;46.41,-2.81,;45.08,-3.59,;49.08,-2.8,;50.41,-2.03,)|
C(CCCN1CCCCC1)CCOc1cccc(c1)-c1ccccc1
C(CCOc1cccc(c1)-c1ccccc1)CCN1CCCCCC1
Oc1ccc(cc1)-c1coc2cc(OCCCCN3CCCCC3)ccc2c1=O
CCN(C)CCCOc1ccc2c(c1)occ(-c1ccc(OC)cc1)c2=O
O=c1c(coc2cc(OCCN3CCCC3)ccc12)-c1ccc(OCCN2CCCCC2)cc1
COc1ccc(cc1)-c1coc2cc(OCCCCN3CCCCC3)ccc2c1=O
CCN(C)CCCCOc1ccc2c(c1)occ(-c1ccc(OCCN3CCCCC3)cc1)c2=O
O=c1c(coc2cc(OCCCCN3CCCCC3)ccc12)-c1ccc(OCCN2CCCCC2)cc1
COc1ccc(cc1)-c1coc2cc(OCCNC3CCCCC3)ccc2c1=O
COc1ccc(cc1)-c1coc2cc(OCCOCCN3CCCCC3)ccc2c1=O
CCN(C)CCCCOc1ccc2c(c1)occ(-c1ccc(OC)cc1)c2=O
O=c1c(coc2cc(OCCN3CCCCC3)ccc12)-c1ccc(OCCN2CCCCC2)cc1
COc1ccc(cc1)-c1coc2cc(OCCNC3CCCC3)ccc2c1=O
COc1ccc(cc1)-c1coc2cc(OCCNc3c4CCCCc4nc4ccccc34)ccc2c1=O
O=S(=O)(N1Cc2ccc(cc2C1)N1CCN(CC1)C1CCC1)c1ccccc1
CCN1CCC(CC1)c1ccc2N(CCc2c1)S(=O)(=O)c1ccccc1
CCN1CCC(CC1)c1cccc2N(CCc12)S(=O)(=O)c1ccccc1
CCN1CCC(CC1)c1ccc2CN(Cc2c1)S(=O)(=O)c1ccccc1
CCN1CCN(CC1)c1ccc2CN(Cc2c1)S(=O)(=O)c1ccccc1
CCN1CCN(CC1)c1cccc2N(CCc12)S(=O)(=O)c1ccccc1
CN1CCC(CC1)c1ccc2N(CCc2c1)S(=O)(=O)c1ccccc1
CCN1CCN(CC1)c1ccc2N(CCc2c1)S(=O)(=O)c1ccccc1
O=S(=O)(N1CCc2c1cccc2C1CCN(CC1)C1CCC1)c1ccccc1
O=S(=O)(N1CCc2c1cccc2N1CCN(CC1)C1CCC1)c1ccccc1
Cc1cc(OCCC[n+]2c(C)cc(C=Cc3cc4CCCN5CCCc(c3)c45)cc2C)ccc1-c1nc2c(C)c(F)ccc2[nH]1
CN(C)c1ccc(C=CC=Cc2cc(C)[n+](CCCOc3ccc(-c4nc5c(C)c(F)ccc5[nH]4)c(C)c3)c(C)c2)cc1
CN(C)c1ccc(C=CC=Cc2cc(C)[n+](CCc3c[nH]cn3)c(C)c2)cc1
CN(C)c1ccc(C=CC=Cc2cc(C)[n+](CCCc3c[nH]cn3)c(C)c2)cc1
CN(C)c1ccc(C=CC=Cc2cc(C)[n+](CCCCc3c[nH]cn3)c(C)c2)cc1
CN(C)c1ccc(C=CC=Cc2cc(C)[n+](CCCCCc3c[nH]cn3)c(C)c2)cc1
CN(C)c1ccc(C=CC=Cc2cc(C)[n+](CCCNCCc3c[nH]cn3)c(C)c2)cc1
CN(C)c1ccc(C=CC=Cc2cc(C)[n+](CCCN3CCc4nc[nH]c4C3)c(C)c2)cc1
CC(C)(C)CNc1nccc(n1)N1CCc2nc[nH]c2C1
Cc1cc(OCCCNC(=O)CCCCCN2\C(=C/C=C/C=C/C3=[N+](CCCCS([O-])(=O)=O)c4ccccc4C3(C)C)C(C)(C)c3ccccc23)ccc1-c1nc2c(C)c(F)ccc2[nH]1 |c:23|
Cc1cc(OCCCNC(=O)CCCCCNC(=O)COc2ccc(\C=C\C3=[N+]4C(C=C3)=Cc3ccc(-c5ccc[nH]5)n3[B-]4(F)F)cc2)ccc1-c1nc2c(C)c(F)ccc2[nH]1 |c:30,32,t:27|
Cc1nccc2-c3ccc(Br)cc3NC(C)(C)c12
Fc1ccc(OCCCCCCN2CCCCCC2)cc1
O=C(c1ccccc1)c1cccc(OCCCCCCN2CCCCCC2)c1
CC(C)(C)c1ccc(OCCCCCCN2CCCCCC2)cc1
C[C@@H]1Cc2c(ccc3[nH]ncc23)[C@H](N1CC(F)(F)F)c1ccc(NC2CN(CCCF)C2)cn1 |r|
CN(C)CC\C=C\c1cccnc1
OCCN(CCO)c1ccc2ncnc(Nc3cccc(Br)c3)c2c1
CCCCCc1cc(c(c(c1)O)[C@@H]2C=C(CC[C@H]2C(=C)C)C)O
C(C1Cc2cc(ccc2O1)-c1ccccc1)N1CCNCC1
CN1CCN(CC2Cc3cc(ccc3O2)-c2ccccc2)CC1
C(C1Cc2cc(ccc2O1)-c1ccccc1)N1CCN(CC1)c1ccccc1
CC(C)(C)c1ccc2OC(CN3CCN(CC3)c3ccccc3)Cc2c1
C(C1Cc2ccccc2O1)N1CCN(Cc2ccccc2)CC1
COc1ccc2OC(CN3CCN(CC=C)CC3)Cc2c1
CC(C)(C)c1ccc2OC(CN3CCN(CC=C)CC3)Cc2c1
C=CCN1CCN(CC2Cc3cc(ccc3O2)-c2ccccc2)CC1
CN1CCN(Cc2cc3ccccc3o2)CC1
CN1CCN(Cc2ccc3OCCc3c2)CC1
CN1CCN(CC1)C(=O)c1cc2ccccc2o1
O=C(N1CCN(CC1)c1ccccc1)c1cc2ccccc2o1
C=CCN1CCN(CC2Cc3ccccc3O2)CC1
CN1CCN(CC2Cc3cc(Cl)ccc3O2)CC1
COc1ccc2OC(CN3CCN(C)CC3)Cc2c1
CN1CCN(CC2Cc3cc(ccc3O2)C(C)(C)C)CC1
CN1CCc2ccc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)cc2C1=O
O=c1c2ccccc2oc2ccc(OCCCCCN3CCCCC3)cc12
Clc1ccc2oc3ccc(OCCCCCN4CCCCC4)cc3c(=O)c2c1
O=c1c2ccccc2oc2ccc(OCCCCCCN3CCCCC3)cc12
Clc1ccc2c(c1)oc1ccc(OCCCCCCN3CCCCC3)cc1c2=O
Clc1ccc2oc3ccc(OCCCCCCN4CCCCC4)cc3c(=O)c2c1
CC1CCCN(CCCCCOc2ccc3oc4ccccc4c(=O)c3c2)C1
CC1CCCN(CCCCCOc2ccc3oc4cc(Cl)ccc4c(=O)c3c2)C1
CC1CCCN(CCCCCOc2ccc3oc4ccc(Cl)cc4c(=O)c3c2)C1
CC1CCCN(CCCCCCOc2ccc3oc4ccccc4c(=O)c3c2)C1
CC1CCCN(CCCCCCOc2ccc3oc4cc(Cl)ccc4c(=O)c3c2)C1
CC1CCCN(CCCCCCOc2ccc3oc4ccc(Cl)cc4c(=O)c3c2)C1
CC1CCN(CCCCCOc2ccc3oc4ccccc4c(=O)c3c2)CC1
CC1CCN(CCCCCOc2ccc3oc4cc(Cl)ccc4c(=O)c3c2)CC1
CC1CCN(CCCCCOc2ccc3oc4ccc(Cl)cc4c(=O)c3c2)CC1
CC1CCN(CCCCCCOc2ccc3oc4ccccc4c(=O)c3c2)CC1
CC1CCN(CCCCCCOc2ccc3oc4cc(Cl)ccc4c(=O)c3c2)CC1
CC1CCN(CCCCCCOc2ccc3oc4ccc(Cl)cc4c(=O)c3c2)CC1
O=c1c2ccccc2oc2ccc(OCCCCCN3CCCCCC3)cc12
Clc1ccc2c(c1)oc1ccc(OCCCCCN3CCCCCC3)cc1c2=O
Clc1ccc2oc3ccc(OCCCCCN4CCCCCC4)cc3c(=O)c2c1
O=c1c2ccccc2oc2ccc(OCCCCCCN3CCCCCC3)cc12
Clc1ccc2c(c1)oc1ccc(OCCCCCCN3CCCCCC3)cc1c2=O
Clc1ccc2oc3ccc(OCCCCCCN4CCCCCC4)cc3c(=O)c2c1
CN(CCCn1ccc(=O)c(O)c1C)CC#C
Clc1ccc(-c2noc(CCCCN3CCOCC3)n2)c(Cl)c1
O=C(C1CC1)c1ccc(OCCCN2CCC(CC2)c2ccncc2)cc1
O=C(C1CC1)c1ccc(OCCCN2CCN(CC2)c2ccncc2)cc1
Clc1ccc(cc1)C(=O)c1ccc(OCCCN2CCN(CC2)c2ccncc2)cc1
Fc1ccc(cc1)C(=O)c1ccc(OCCCN2CCN(CC2)c2ccncc2)cc1
Clc1ccc(cc1)-c1ccc(OCCCN2CCN(CC2)c2ccncc2)cc1
Clc1cccc(c1)-c1ccc(OCCCN2CCN(CC2)c2ccncc2)cc1
Fc1ccc(cc1)-c1ccc(OCCCN2CCN(CC2)c2ccncc2)cc1
N#Cc1ccc(cc1)-c1ccc(OCCCN2CCN(CC2)c2ccncc2)cc1
C(COc1ccc(Nc2ccccc2)cc1)CN1CCN(CC1)c1ccncc1
C(COc1ccc(Cc2ccccc2)cc1)CN1CCN(CC1)c1ccncc1
C(COc1ccc(Oc2ccccc2)cc1)CN1CCN(CC1)c1ccncc1
C(COc1ccc2ccccc2c1)CN1CCN(CC1)c1ccncc1
CN(C)[C@@H]1CCN(CCCOc2ccc(cc2F)-c2ccc(cc2)C#N)C1 |r|
O=C(c1ccccc1)c1ccc(OCCCN2CCN(CC2)c2ccncc2)cc1
COc1c(C)n(ccc1=O)-c1ccc(OCCCN2CCCC2)cc1
COc1c(C)n(ccc1=O)-c1ccc(OCCCN2CCCCC2)cc1
COc1c(C)n(ccc1=O)-c1ccc(OCCCN2CCOCC2)cc1
COc1c(C)n(ccc1=O)-c1ccc(OCCCN2CCN(C)CC2)cc1
COc1c(C)n(ccc1=O)-c1ccc(OCCN2CCCC2)cc1
COc1c(C)n(ccc1=O)-c1ccc(OCCCCN2CCCC2)cc1
CCc1c(OC)c(=O)ccn1-c1ccc(OCCCN2CCCC2)cc1
COc1cn(c(C)cc1=O)-c1ccc(OCCCN2CCCC2)cc1
COc1cn(ccc1=O)-c1ccc(OCCCN2CCCC2)cc1
CCOc1c(C)n(ccc1=O)-c1ccc(OCCCN2CCCC2)cc1
COc1c(C)n(ccc1=O)-c1ccc(OC2CCN(CC2)C(C)C)cc1
COc1cn(ccc1=O)-c1ccc(OC2CCN(CC2)C(C)C)cc1
COc1c(C)n(ccc1=O)-c1ccc(OC2CCN(CC2)C2CCC2)cc1
COc1cn(ccc1=O)-c1ccc(OC2CCN(CC2)C2CCC2)cc1
COc1c(C)n(ccc1=O)-c1ccc(OC2CCN(CC2)C2CCCC2)cc1
COc1cn(ccc1=O)-c1ccc(OC2CCN(CC2)C2CCCC2)cc1
COc1c(C)n(ccc1=O)-c1ccc(cc1)C(=O)N1CCN(CC1)C(C)C
COc1c(C)n(ccc1=O)-c1ccc(cc1)C(=O)N1CCN(CC1)C1CCC1
COc1c(C)n(ccc1=O)-c1ccc(cc1)C(=O)N1CCN(CC1)C1CCCC1
COc1c(C)n(ccc1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(C)C
COc1c(C)n(ccc1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)C1CCC1
COc1c(C)n(ccc1=O)-c1ccc(cc1)S(=O)(=O)N1CCN(CC1)C1CCCC1
CN1CCN(CC1)c1nc2ccccc2n2cnnc12
CN1CCN(CC1)c1nc2ccc(cc2n2cnnc12)[N+]([O-])=O
CN1CCN(CC1)c1nc2ccc(C)cc2n2cnnc12
CN1CCN(CC1)c1cc2ccc(Cl)cc2n2cnnc12
CN1CCN(CC1)c1nc2ncc(Br)cc2n2cnnc12
CN1CCN(CC1)c1nc2ncc(cc2n2cnnc12)C(F)(F)F
CN1CCN(CC1)c1nc2ncc(cc2n2cnnc12)C#N
CN1CCN(CC1)c1nc2nc(C#N)c(Cl)cc2n2cnnc12
CN1CCN(CC1)c1nc2ncc(Br)c(C)c2n2cnnc12
CN1CCCN(CC1)c1nc2ncc(Cl)cc2n2cnnc12
Clc1cnc2nc(N3CCN4CCCC4C3)c3nncn3c2c1
CN1CCN(CC1)c1nc2ncc(Cl)cc2c2ncnn12
CN1CCN(CC1)c1nc2ncc(Cl)cc2n2nnnc12
CN1CCN(CC1)c1nc2ncc(Br)cc2n2nnnc12
Oc1coc(\C=C\c2ccc(OCCCN3CCCC3)cc2)cc1=O
Oc1coc(\C=C\c2ccc(OCCCN3CCCCC3)cc2)cc1=O
Oc1coc(\C=C\c2ccc(OCCCN3CCOCC3)cc2)cc1=O
CN1CCN(CCCOc2ccc(\C=C\c3cc(=O)c(O)co3)cc2)CC1
CCN(CC)CCCOc1ccc(\C=C\c2cc(=O)c(O)co2)cc1
CN(C)CCCOc1ccc(\C=C\c2cc(=O)c(O)co2)cc1
Cc1oc(\C=C\c2ccc(OCCCN3CCCC3)cc2)cc(=O)c1O
Cc1oc(\C=C\c2ccc(OCCCN3CCCCC3)cc2)cc(=O)c1O
Cn1cc(O)c(=O)cc1\C=C\c1ccc(OCCCN2CCCC2)cc1
Cn1cc(O)c(=O)cc1\C=C\c1ccc(OCCCN2CCCCC2)cc1
Cn1cc(O)c(=O)cc1\C=C\c1ccc(OCCCN2CCOCC2)cc1
CN1CCN(CCCOc2ccc(\C=C\c3cc(=O)c(O)cn3C)cc2)CC1
CCN(CC)CCCOc1ccc(\C=C\c2cc(=O)c(O)cn2C)cc1
CN(C)CCCOc1ccc(\C=C\c2cc(=O)c(O)cn2C)cc1
CCn1cc(O)c(=O)cc1\C=C\c1ccc(OCCCN2CCCC2)cc1
CCn1cc(O)c(=O)cc1\C=C\c1ccc(OCCCN2CCCCC2)cc1
Oc1cccc2ccc(\C=C\c3ccc(OCCCN4CCCC4)cc3)nc12
Oc1cccc2ccc(\C=C\c3ccc(OCCCN4CCCCC4)cc3)nc12
C[C@@H](NC(=O)\N=C(/N)NCCCc1sc(N)nc1C)c1ccccc1 |r|
CCCCCNC(=O)\N=C(/N)NCCCc1sc(N)nc1C
CC(NC(=O)\N=C(/N)NCCCc1sc(N)nc1C)c1cccc(F)c1
CC(CNC(=O)\N=C(/N)NCCCc1sc(N)nc1C)C1CCCCC1
CCCNC(=O)\N=C(/N)NCCCc1sc(N)nc1C
CCCCCCNC(=O)\N=C(/N)NCCCc1sc(N)nc1C
Cc1nc(N)sc1CCCN\C(N)=N\C(=O)NCc1ccccc1
Cc1nc(N)sc1CCCN\C(N)=N\C(=O)NC(c1ccccc1)c1ccccc1
C[C@H](NC(=O)\N=C(/N)NCCCc1sc(N)nc1C)c1ccccc1 |r|
Cc1nc(N)sc1CCCN\C(N)=N\C(=O)NC(c1ccccc1)C(F)(F)F
CCC(NC(=O)\N=C(/N)NCCCc1sc(N)nc1C)c1ccccc1
CC(C)C(NC(=O)\N=C(/N)NCCCc1sc(N)nc1C)c1ccccc1
CC(NC(=O)\N=C(/N)NCCCc1sc(N)nc1C)c1ccc(C)cc1
CC(NC(=O)\N=C(/N)NCCCc1sc(N)nc1C)c1ccc(F)cc1
CC(NC(=O)\N=C(/N)NCCCc1sc(N)nc1C)c1ccc(Cl)cc1
CC(NC(=O)\N=C(/N)NCCCc1sc(N)nc1C)c1ccc(Br)cc1
COc1ccc(cc1)C(C)NC(=O)\N=C(/N)NCCCc1sc(N)nc1C
CC(NC(=O)\N=C(/N)NCCCc1sc(N)nc1C)c1ccc(OC(F)(F)F)cc1
CC(NC(=O)\N=C(/N)NCCCc1sc(N)nc1C)c1ccccc1F
Cc1nc(N)sc1CCCN\C(N)=N\C(=O)NCc1ccco1
CC(NC(=O)\N=C(/N)NCCCc1sc(N)nc1C)c1ccco1
CC(NC(=O)\N=C(/N)NCCCc1sc(N)nc1C)c1cccs1
Cc1nc(N)sc1CCCN\C(N)=N\C(=O)NCC(c1ccccc1)c1ccccc1
C[C@@H](CNC(=O)\N=C(/N)NCCCc1sc(N)nc1C)c1ccccc1 |r|
C[C@H](CNC(=O)\N=C(/N)NCCCc1sc(N)nc1C)c1ccccc1 |r|
CCC(CNC(=O)\N=C(/N)NCCCc1sc(N)nc1C)c1ccccc1
CC(C)C(CNC(=O)\N=C(/N)NCCCc1sc(N)nc1C)c1ccccc1
CC(C)c1ccc(cc1)C(C)CNC(=O)\N=C(/N)NCCCc1sc(N)nc1C
CC(CNC(=O)\N=C(/N)NCCCc1sc(N)nc1C)CC1CCCCC1
CC(CNC(=O)\N=C(/N)NCCCc1sc(N)nc1C)Cc1ccc(C)cc1
CC(CCc1ccccc1)CNC(=O)\N=C(/N)NCCCc1sc(N)nc1C
CC(CCCc1ccccc1)CNC(=O)\N=C(/N)NCCCc1sc(N)nc1C
Cc1nc(N)sc1CCCN\C(N)=N\C(=S)NC(c1ccccc1)c1ccccc1
C[C@@H](NC(=S)\N=C(/N)NCCCc1sc(N)nc1C)c1ccccc1 |r|
C[C@H](NC(=S)\N=C(/N)NCCCc1sc(N)nc1C)c1ccccc1 |r|
Cc1nc(N)sc1CCCN\C(N)=N\C(=S)NCC(c1ccccc1)c1ccccc1
C[C@@H](CNC(=S)\N=C(/N)NCCCc1sc(N)nc1C)c1ccccc1 |r|
C[C@H](CNC(=S)\N=C(/N)NCCCc1sc(N)nc1C)c1ccccc1 |r|
CCCCCCNC(=O)\N=C(/N)Nc1cccc(c1)-c1csc(N)n1
CCCCCCNC(=O)\N=C(/N)NC1CCc2nc(N)sc2C1
N\C(NC1CCc2nc(N)sc2C1)=N/C(=O)NCc1ccccc1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CN3CCCC3)cc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CN3CCCC3)cc2Cl)CC1
Cc1cc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)ccc1CN1CCCC1
COc1cc(CN2CCCC2)ccc1OCCCN1CCC(CC1)c1noc2cc(F)ccc12
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CN3CCCCC3)cc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CCN3CCCCC3)cc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CN3CCCCC3)cc2F)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CN3CCCCC3)c(F)c2)CC1
COc1cc(CN2CCCCC2)ccc1OCCCN1CCC(CC1)c1noc2cc(F)ccc12
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CN3CCOCC3)cc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCCOc2ccc(CN3CCOCC3)cc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CN3CCOCC3)cc2F)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CN3CCOCC3)c(F)c2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CN3CCOCC3)cc2Cl)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CN3CCOCC3)c(Cl)c2)CC1
Cc1cc(OCCCN2CCC(CC2)c2noc3cc(F)ccc23)ccc1CN1CCOCC1
COc1cc(CN2CCOCC2)ccc1OCCCN1CCC(CC1)c1noc2cc(F)ccc12
CC1CCN(CCc2ccc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)cc2)CC1
CC1CCN(CCc2ccc(OCCCCN3CCC(CC3)c3noc4cc(F)ccc34)cc2)CC1
CN1CCN(Cc2ccc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)cc2)CC1
CN1CCN(Cc2ccc(OCCCCN3CCC(CC3)c3noc4cc(F)ccc34)cc2)CC1
CN1CCN(CCc2ccc(OCCCN3CCC(CC3)c3noc4cc(F)ccc34)cc2)CC1
Fc1ccc2c(noc2c1)C1CCN(CCCOc2ccc(CCN3CCOCC3)cc2)CC1
CC1=C(C(=O)N2CCCCC2=N1)CCN3CCC(CC3)c4c5ccc(cc5on4)F
Nc1nc-2c(Cc3ccccc-23)c(n1)-c1ccc(OCCCN2CCCCC2)cc1
Nc1nc-2c(Cc3cc(OCCCN4CCCC4)ccc-23)c(n1)-c1ccccc1
Nc1nc-2c(Cc3cc(OCCCN4CCCCC4)ccc-23)c(n1)-c1ccc(OCCCN2CCCCC2)cc1
Nc1nc-2c(Cc3ccc(OCCCN4CCCC4)cc-23)c(n1)-c1ccccc1
Nc1nc-2c(Cc3cc(OCCCN4CCCCC4)ccc-23)c(n1)-c1ccccc1
Nc1nc-2c(Cc3ccc(OCCCN4CCCCC4)cc-23)c(n1)-c1ccccc1
Nc1nc2-c3ccccc3C(=O)c2c(n1)-c1ccc(OCCCN2CCCCC2)cc1
Nc1nc2-c3ccc(OCCCN4CCCC4)cc3C(=O)c2c(n1)-c1ccccc1
Nc1nc2-c3ccc(OCCCN4CCCCC4)cc3C(=O)c2c(n1)-c1ccc(OCCCN2CCCCC2)cc1
Nc1nc2-c3cc(OCCCN4CCCC4)ccc3C(=O)c2c(n1)-c1ccccc1
Nc1nc2-c3ccc(OCCCN4CCCCC4)cc3C(=O)c2c(n1)-c1ccccc1
Nc1nc2-c3cc(OCCCN4CCCCC4)ccc3C(=O)c2c(n1)-c1ccccc1
CN(C)c1ccc2c(-c3ccc(cc3C([O-])=O)C(=O)NCCOCCOCCOCCNC(=O)C3CCN(Cc4ccc(OCCCN5CCCCC5)cc4)CC3)c3ccc(cc3oc2c1)=[N+](C)C |(50.94,-7.72,;49.61,-6.94,;49.62,-5.4,;48.28,-7.7,;46.93,-6.92,;45.6,-7.69,;45.59,-9.23,;44.26,-9.99,;42.94,-9.22,;41.6,-9.98,;40.27,-9.21,;40.28,-7.67,;41.61,-6.9,;42.94,-7.67,;44.27,-6.9,;45.75,-6.49,;44.27,-5.36,;38.95,-6.89,;38.95,-5.35,;37.61,-7.66,;36.28,-6.88,;34.94,-7.65,;33.61,-6.87,;32.28,-7.64,;30.95,-6.86,;29.61,-7.63,;28.28,-6.85,;26.94,-7.62,;25.61,-6.84,;24.27,-7.61,;22.94,-6.83,;21.61,-7.6,;20.28,-6.82,;20.28,-5.28,;18.94,-7.59,;18.93,-9.13,;17.6,-9.89,;16.28,-9.11,;14.94,-9.88,;13.61,-9.11,;12.28,-9.88,;10.94,-9.11,;10.95,-7.57,;9.62,-6.8,;8.28,-7.57,;6.95,-6.79,;5.61,-7.56,;4.28,-6.79,;2.95,-7.55,;1.63,-6.79,;1.63,-5.25,;2.95,-4.47,;4.28,-5.25,;12.28,-6.8,;13.6,-7.57,;16.26,-7.58,;17.6,-6.81,;44.26,-11.53,;42.94,-12.29,;42.93,-13.82,;44.25,-14.58,;45.57,-13.83,;45.58,-12.31,;46.92,-11.55,;46.93,-10,;48.27,-9.25,;44.25,-16.12,;42.92,-16.9,;45.58,-16.9,)|
CCN1CCN(CC1)C(=O)c1ccc(s1)-c1nc2ccccc2s1
NCCOCCOCCOCCNC(=O)C1CCN(Cc2ccc(OCCCN3CCCCC3)cc2)CC1
O=C1CNC(=O)[C@H](Cc2ccc(OCCCN3CCCCC3)cc2)N1 |r|
O=C1CNC(=O)[C@@H](Cc2ccc(OCCCN3CCCCC3)cc2)N1 |r|
C[C@@H]1NC(=O)[C@H](Cc2ccc(OCCCN3CCCCC3)cc2)NC1=O |r|
CC(C)[C@@H]1NC(=O)[C@H](Cc2ccc(OCCCN3CCCCC3)cc2)NC1=O |r|
O=C1N[C@@H](Cc2ccc(OCCCN3CCCCC3)cc2)C(=O)N[C@H]1Cc1ccccc1 |r|
C(COc1ccc(C[C@H]2CNCCN2)cc1)CN1CCCCC1 |r|
C(COc1ccc(C[C@H]2CN[C@@H](Cc3ccccc3)CN2)cc1)CN1CCCCC1 |r|
CC(=O)N1CC(=O)N\C(=C/c2ccc(OCCCN3CCCCC3)cc2)C1=O
O=C1CNC(=O)\C(N1)=C\c1ccc(OCCCN2CCCCC2)cc1
O=c1[nH]\c(=C/c2ccc(OCCCN3CCCCC3)cc2)c(=O)[nH]\c1=C/c1ccccc1
CC(=O)N1[C@@H](Cc2ccccc2)C(=O)N\C(=C/c2ccc(OCCCN3CCCCC3)cc2)C1=O |r|
O=C1N\C(=C/c2ccc(OCCCN3CCCCC3)cc2)C(=O)N[C@H]1Cc1ccccc1 |r|
O=C1CN(Cc2ccc(OCCCN3CCCCC3)cc2)C(=O)CN1
O=C(N1CCNC(=O)C1)c1ccc(OCCCN2CCCCC2)cc1
O=C1CN(Cc2ccc(OCCCN3CCCCC3)cc2)CCN1Cc1ccccc1
O=C(N1CCN(Cc2ccccc2)C(=O)C1)c1ccc(OCCCN2CCCCC2)cc1
CCCCCNC(=O)N=C(/N)Nc1ccc(cc1)-c1sc(N)nc1C
CCCCCNC(=O)N=C(/N)NCC1CCc2nc(N)sc2C1
Cc1nc(N)sc1-c1ccc(NC(N)=NC(=O)NC2CCCCC2)cc1
CC(CNC(=O)N=C(/N)NCCCc1nnc(C)s1)C1CCCCC1
Cc1nc(N)sc1-c1ccc(NC(N)=NC(=O)NCc2ccccc2)cc1
NC(NCC1CCc2nc(N)sc2C1)=N/C(=O)NCc1ccccc1
CC(CNC(=O)N=C(/N)Nc1ccc(cc1)-c1sc(N)nc1C)Cc1ccc(C)cc1
CC(CNC(=O)N=C(/N)NCC1CCc2nc(N)sc2C1)Cc1ccc(C)cc1
CC(CCCc1ccccc1)CNC(=O)N=C(/N)Nc1ccc(cc1)-c1sc(N)nc1C
CC(CCCc1ccccc1)CNC(=O)N=C(/N)NCC1CCc2nc(N)sc2C1
CCCCCNC(=O)N=C(/N)NCCCc1nnc(N)s1
CCCCCNC(=O)N=C(/N)NCCCc1cnc(N)s1
CCCCCNC(=O)N=C(/N)Nc1cccc(c1)-c1sc(N)nc1C
CCCCCCNC(=O)N=C(/N)NCCCc1nnc(N)s1
CCCCCCNC(=O)N=C(/N)NCCCc1nnc(N)o1
Cc1nnc(CCCNC(N)=NC(=O)NCCCCCCCCN)s1
NCCCCCCCCNC(=O)N=C(/N)NCCCc1nnc(N)s1
CC(CNC(=O)N=C(/N)NCCCc1oc(N)nc1C)C1CCCCC1
CC(CNC(=O)N=C(/N)NCCCc1nnc(N)s1)C1CCCCC1
CC(CNC(=O)N=C(/N)Nc1ccc(cc1)-c1sc(N)nc1C)C1CCCCC1
Cc1nc(N)oc1CCCNC(N)=NC(=O)NCc1ccccc1
Cc1nnc(CCCNC(N)=NC(=O)NCc2ccccc2)s1
NC(NCCCc1nnc(N)s1)=N/C(=O)NCc1ccccc1
NC(NCCCc1cnc(N)s1)=N/C(=O)NCc1ccccc1
Cc1nc(N)sc1-c1cccc(NC(N)=NC(=O)NCc2ccccc2)c1
C[C@@H](NC(=O)N=C(/N)NCCCc1c[nH]cn1)c1ccccc1
C[C@@H](NC(=O)N=C(/N)NCCCc1nnc(N)s1)c1ccccc1
C[C@@H](NC(=O)N=C(/N)NCCCc1ncn[nH]1)c1ccccc1
C[C@@H](NC(=O)N=C(/N)NCCCn1cc(CN(C)C)nn1)c1ccccc1
CC(NC(=O)N=C(/N)NCCCc1nnc(N)s1)c1cccc(F)c1
CC(CNC(=O)N=C(/N)NCCCc1nnc(N)s1)Cc1ccc(C)cc1
CC(CNC(=O)N=C(/N)NCCCc1nnc(N)o1)Cc1ccc(C)cc1
CC(CNC(=O)N=C(/N)NCCCc1cnc(N)s1)Cc1ccc(C)cc1
CC(CNC(=O)N=C(/N)Nc1cccc(c1)-c1sc(N)nc1C)Cc1ccc(C)cc1
CC(CCCc1ccccc1)CNC(=O)N=C(/N)NCCCc1nnc(N)s1
CC(CCCc1ccccc1)CNC(=O)N=C(/N)Nc1cccc(c1)-c1sc(N)nc1C
Cc1nc(N)sc1-c1ccc(NC(N)=NC(=O)NCCCCCCNC(=O)N=C(/N)Nc2ccc(cc2)-c2sc(N)nc2C)cc1
Cc1nc(N)sc1-c1cccc(NC(N)=NC(=O)NCCCCCCNC(=O)N=C(/N)Nc2cccc(c2)-c2sc(N)nc2C)c1
NC(NCCCc1nnc(N)s1)=N/C(=O)NCCCCCCNC(=O)N=C(/N)NCCCc1nnc(N)s1
NC(NCCCc1nnc(N)s1)=N/C(=O)NCCCCCCCCNC(=O)N=C(/N)NCCCc1nnc(N)s1
CCCCCNC(=O)N=C(N)NCCCc1nnc(C)s1
CC(C)[C@H](NC(=O)CCN1CCC(CC1)Oc1ccccc1Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(\C=C\C2=[N+]3C(C=C2)=Cc2ccc(-c4cccs4)n2[B-]3(F)F)cc1)C(N)=O |r,c:73,75,t:70|
C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCN1CCC(CC1)Oc1ccccc1Cc1ccccc1)C(=O)NCCC(=O)N[C@@H](CCCCNC(=O)COc1ccc(\C=C\C2=[N+]3C(C=C2)=Cc2ccc(-c4cccs4)n2[B-]3(F)F)cc1)C(N)=O |r,c:74,76,t:71|
CN1CCN(CCCOc2ccc3ccccc3c2)CC1
C(COc1cccc2ccccc12)CN1CCN(CC1)c1ccccc1
C(COc1ccc2ccccc2c1)CN1CCN(CC1)c1ccccc1
CN1CCN(CCOC(=O)c2ccc3ccccc3c2)CC1
CN1CCN(CCCOC(=O)c2cccc3ccccc23)CC1
CN1CCN(CCCOC(=O)c2ccc3ccccc3c2)CC1
O=C(OCCCN1CCN(CC1)c1ccccc1)c1cccc2ccccc12
CN1CCN(CCCOC(=O)c2cc3ccccc3o2)CC1
O=C(OCCCN1CCN(CC1)c1ccccc1)c1cc2ccccc2o1
O=C(OCCCN1CCN(CC1)c1ccncc1)c1cc2ccccc2o1
O=C(NCCCN1CCN(CC1)c1ccncc1)c1cc2ccccc2o1
[H][C@@]12CC[C@H](N3CCCC3)[C@@]1(C)CC[C@]1([H])c3ccc(OCc4ccccn4)cc3CC[C@@]21[H] |r|
[H][C@@]12CC[C@H](N3CCCC3)[C@@]1(CC)CC[C@]1([H])c3ccc(OCCCN4CCCC4)cc3CC[C@@]21[H] |r|
[H][C@@]12CC[C@H](N3CCCC3)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCCC4)cc3C[C@@H](C)[C@@]21[H] |r|
[H][C@@]12CC[C@H](N3CCCC3)[C@@]1(C)CC[C@]1([H])c3ccc(OCCN4CCCC4)cc3CC[C@@]21[H] |r|
[H][C@@]12CC[C@H](N3CCCC3)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCCN4CCCC4)cc3CC[C@@]21[H] |r|
[H][C@@]12CCC(N3CCCC3)[C@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCCC4)cc3CC[C@@]21[H] |r|
[H][C@@]12CC[C@H](N3CCCC3)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCC(CC4)C(N)=O)cc3CC[C@@]21[H] |r|
[H][C@@]12CC[C@H](N3CCCC3)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCC(O)CC4)cc3CC[C@@]21[H] |r|
[H][C@@]12CC[C@H](N3CCCC3)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCC(O)C4)cc3CC[C@@]21[H] |r|
[H][C@@]12CC[C@H](N3CCCC3)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCC(CC4)C(C)=O)cc3CC[C@@]21[H] |r|
[H][C@@]12CC[C@H](N3CCCC3)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCCC4C)cc3CC[C@@]21[H] |r|
[H][C@@]12CC[C@H](N3CCCC3)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCC[C@@H]4C)cc3CC[C@@]21[H] |r|
[H][C@@]12CC[C@H](N3CCCC3)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCNC(=O)C4)cc3CC[C@@]21[H] |r|
[H][C@@]12CC[C@H](N3CCCC3)[C@@]1(C)CC[C@]1([H])c3ccc(OCCCN4CCCCCC4)cc3CC[C@@]21[H] |r|
[H][C@@]12CC[C@H](N3CCCC3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC=C2C[C@H](CC[C@]12C)OCCCN1CCCC1 |r,t:22|
[H][C@@]12CC[C@H](N3CCCC3)[C@@]1(C)CC[C@]1([H])c3ccc(OCc4ccncc4)cc3CC[C@@]21[H] |r|
[H][C@@]12CC[C@H](N3CCCC3)[C@@]1(C)CC[C@]1([H])c3ccc(OCc4cccnc4)cc3CC[C@@]21[H] |r|
[H][C@@]12CC[C@H](N3CCCC3)[C@@]1(C)CC[C@]1([H])c3ccc(OCc4ccc(Cl)cn4)cc3CC[C@@]21[H] |r|
[H][C@@]12CC[C@@]3([H])[C@]4([H])CCCN(C)[C@@]4(C)CC[C@]3([H])[C@@]1(C)CC[C@@H](C2)OC(=O)CCN1CCCC1 |r|
[H][C@@]12CC[C@H](N3CCCC3)[C@@]1(C)CC[C@]1([H])c3ccc(OCc4ccccc4)cc3CC[C@@]21[H] |r|
CCN(CC)CCCC(C)Nc1cnc(cn1)C(=O)Nc1ccc(Cl)c2cccnc12
CCN(CC)CCCC(C)Nc1cnc(cn1)C(=O)Nc1cc(F)cc2cccnc12
CCCCCCCC\C=C/CCCCCCCC(=O)NC(CO)(CO)CO
CCCN1CCN(CC1)c1ccc2CCCC(N(C)C(=O)OCc3ccccc3)c2c1
CC1CCCN(CCCOc2ccc(cc2)-c2ccccc2)C1
CC1CCN(CCCOc2ccc(cc2)-c2ccccc2)CC1
C(COc1ccc(cc1)-c1ccccc1)CN1CCCCCC1
C(COc1ccc(cc1)-c1ccccc1)CN1CCCC1
N#Cc1ccc(cc1)-c1ccc(OCCCN2CCCCC2)cc1
C(COc1ccc(Oc2ccccc2)cc1)CN1CCCCC1
C(COc1ccc(Nc2ccccc2)cc1)CN1CCCCC1
C(COc1ccc(Cc2ccccc2)cc1)CN1CCCCC1
C(CCN1CCCCC1)COc1ccc(cc1)-c1ccccc1
N#Cc1ccc(cc1)-c1ccc(OCCCN2CCC(CC2)c2ccncc2)cc1
C(COc1ccc(Oc2ccccc2)cc1)CN1CCC(CC1)c1ccncc1
C(COc1ccc(Nc2ccccc2)cc1)CN1CCC(CC1)c1ccncc1
C(COc1ccc(Cc2ccccc2)cc1)CN1CCC(CC1)c1ccncc1
Cc1cc(OCCN2CCOCC2)nn1-c1ccc2ccccc2c1
C[C@]12CC[C@@H]3c4ccc(OCCCN5CCCC5)cc4CC[C@H]3[C@@H]1CCCN2
CN1CCC[C@H]2[C@@H]3CCc4cc(OCCCN5CCCC5)ccc4[C@H]3CC[C@@]21C
C[C@]12CC[C@@H]3c4ccc(OCCCN5CCCC5)cc4CC[C@H]3[C@@H]1CCCN2CCO
C[C@]12CC[C@@H]3c4ccc(OCCCN5CCCC5)cc4CC[C@H]3[C@@H]1CCCN2C=O
CC(=O)N1CCC[C@H]2[C@@H]3CCc4cc(OCCCN5CCC[C@H]5C)ccc4[C@H]3CC[C@@]21C
CCC(=O)N1CCC[C@H]2[C@@H]3CCc4cc(OCCCN5CCC[C@H]5C)ccc4[C@H]3CC[C@@]21C
C[C@@H]1CCCN1CCCOc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CCCN2C(=O)C(C)(C)C
C[C@@H]1CCCN1CCCOc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CCCN2C(=O)c1ccccc1
C[C@@H]1CCCN1CCCOc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@]2(C)NC(=O)CC[C@@H]12
C[C@@H]1CCCN1CCCOc1ccc2c(c1)CC[C@H]1[C@@H]3[C@H](C#N)CC(=O)N[C@@]3(C)CC[C@H]21
CC(=O)N[C@]12CCC(=O)N[C@@]1(C)CC[C@@H]1c3ccc(OCCCN4CCC[C@H]4C)cc3CC[C@H]12
C[C@@H]1CC(=O)N[C@@]2(C)CC[C@@H]3c4ccc(OCCCN5CCC[C@H]5C)cc4CC[C@H]3[C@H]12
C[C@@H]1CCCN1CCCOc1ccc2c(c1)CC[C@H]1[C@@H]3[C@@H]4C[C@@H]4C(=O)N[C@@]3(C)CC[C@H]21
C[C@@H]1CCCN1CCCOc1ccc2c(c1)CC[C@H]1[C@H]3[C@@H]4C[C@@H]4C(=O)N[C@@]3(C)CC[C@H]21
C[C@@H]1CCCN1CCCOc1ccc2c(c1)CC[C@H]1C3=CCC(=O)N[C@@]3(C)CC[C@H]21
C[C@@H]1CCCN1CCCOc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@]2(C)NC(=O)CC[C@H]12
C[C@@H]1CCCN1CCCOc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@@]2(C)NC(=O)CC[C@@H]12
C[C@@H]1C[C@H]2[C@@H]3CCc4cc(OCCCN5CCC[C@H]5C)ccc4[C@H]3CC[C@]2(C)NC1=O
C[C@@H]1CCCN1CCCOc1ccc2c(c1)CC[C@H]1[C@@H]3[C@H](C#N)CC(=O)N(C)[C@@]3(C)CC[C@H]21
C[C@@H]1CCCN1CCCOc1ccc2c(c1)CC[C@H]1[C@@H]3[C@@H]4C[C@@H]4C(=O)N(C)[C@@]3(C)CC[C@H]21
C[C@@H]1CC(=O)N(C)[C@@]2(C)CC[C@@H]3c4ccc(OCCCN5CCC[C@H]5C)cc4CC[C@H]3[C@H]12
C[C@@H]1C[C@@H]2[C@@H]3CCc4cc(OCCCN5CCC[C@H]5C)ccc4[C@H]3CC[C@]2(C)N(C)C1=O
C[C@@H]1CCCN1CCCOc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CCC(=O)N2C
C[C@@H]1CCCN1CCCOc1ccc2c(c1)CC[C@H]1C3=CCC(=O)N(C)[C@@]3(C)CC[C@H]21
C[C@@H]1CCCN1CCCOc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@@H]1CCC(=O)N2C
C[C@@H]1CCCN1CCCOc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CCCN2C(=O)C1CCOC1
Cc1ccc(NC(=O)C[C@H](CCC(O)=O)c2noc([C@@H]3C[C@H](CC(C)(C)C)C3)c2C2CC2)c(Cl)c1 |r,wU:19.18,21.21,wD:9.9,(16.24,-21,;15.33,-19.75,;13.8,-19.91,;12.9,-18.67,;13.53,-17.27,;12.62,-16.02,;11.09,-16.18,;10.19,-14.93,;10.46,-17.58,;8.93,-17.74,;8.3,-19.15,;9.21,-20.4,;8.58,-21.8,;7.05,-21.97,;9.48,-23.05,;8.03,-16.5,;8.51,-15.03,;7.26,-14.12,;6.02,-15.03,;4.54,-14.56,;3.84,-13.19,;2.47,-13.89,;1.01,-13.41,;.68,-11.91,;-.79,-11.43,;1.83,-10.88,;.28,-10.41,;3.17,-15.26,;6.49,-16.5,;5.58,-17.74,;4.17,-18.37,;5.41,-19.28,;15.05,-17.1,;15.67,-15.69,;15.96,-18.34,)|
CCCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(cc2n(ncc12)C(C)C)-c1ccc(nc1)N1CCN(CC1)C(C)C