255 SMILES Strings for G protein-activated inward rectifier potassium channel 4

Compound Name
SMILES String
CC(C)Nc1cc(ncc1-n1cc(cn1)C(C)(C)O)-c1cnn2cc(cnc12)C#N
CC(C)Nc1cc(ncc1-c1cnn(c1)C1CCOCC1)-c1cnc2cc(Cl)cnn12
CC(C)Nc1cc(ncc1-c1cnn(c1)C1CCOCC1)-c1cnc2cc(cnn12)C#N
CC(C)Nc1cc(ncc1-c1cnn(CC(C)(C)O)c1)-c1cnc2cc(Cl)cnn12
CC(C)Nc1cc(ncc1-c1cnn(CC(C)(C)O)c1)-c1cnc2cc(cnn12)C#N
CCCn1cc(cn1)-c1cnc(cc1NC(C)C)-c1cnc2cc(cnn12)C#N
CC(C)Nc1cc(ncc1-c1cnn(CC(F)(F)F)c1)-c1cnc2cc(cnn12)C#N
CCCn1cc(cn1)-c1cnc(cc1Nc1cnn(CC(F)F)c1)-c1cnc2cc(Cl)cnn12
CCCn1cc(cn1)-c1cnc(cc1Nc1cnn(CC(F)F)c1)-c1cnc2cc(cnn12)C#N
CCCc1cn(nn1)-c1cnc(cc1NC(C)C)-c1cnn2cc(Cl)cnc12
CCCc1cn(nn1)-c1cnc(cc1NC(C)C)-c1cnn2cc(cnc12)C#N
CC(C)Nc1cc(ncc1-n1cc(CCC(C)(C)O)nn1)-c1cnn2cc(Cl)cnc12
CC(C)(O)CCc1cn(nn1)-c1cnc(cc1NC1COC1)-c1cnn2cc(Cl)cnc12
CCCc1cn(nn1)-c1cnc(cc1NC(C)C)-c1cnc2cc(cnn12)C#N
CC(C)Nc1cc(ncc1-c1cn(nn1)C1CCOCC1)-c1cnc2cc(cnn12)C#N
CC(C)Nc1cc(ncc1-c1cn(nn1)C1CN(C1)C(C)=O)-c1cnc2cc(cnn12)C#N
CCCn1cc(nn1)-c1cnc(cc1NC1CC1)-c1cnc2cc(cnn12)C#N
CCCn1cc(nn1)-c1cnc(cc1NC1CC1)-c1cnc2cc(Cl)cnn12
CCCn1cc(nn1)-c1cnc(cc1NC(C)C)-c1cnc2cc(Cl)cnn12
COC(=O)N1CCC(n2cc(nn2)-c2cnc(cc2NC2CC2)-c2cnc3cc(Cl)cnn23)[C@](C)(O)C1 |r|
CC(C)Nc1cc(ncc1-n1cc(CCC(C)(C)O)nn1)-c1cnc2cc(cnn12)C#N
CC(C)(O)CCc1cn(nn1)-c1cnc(cc1NC1CCOCC1)-c1cnn2cc(Cl)cnc12
CC(C)(O)CCc1cn(nn1)-c1cnc(cc1NC1CC(F)(F)C1)-c1cnn2cc(cnc12)C#N
CC(C)(O)CCc1cn(nn1)-c1cnc(cc1N[C@H]1CC[C@H](F)C1)-c1cnn2cc(cnc12)C#N |r|
CC(C)(O)CCc1cn(nn1)-c1cnc(cc1NC1COC1)-c1cnn2cc(cnc12)C#N
CC(C)Nc1cc(ncc1-c1cnn(CCC(C)(C)O)c1)-c1cnc2cc(cnn12)C#N
CC(C)Nc1cc(ncc1-c1cc([nH]n1)C1CCOCC1)-c1cnc2cc(cnn12)C#N
CC(C)(O)CCc1cc(n[nH]1)-c1cnc(cc1NC1CCOCC1)-c1cnn2cc(cnc12)C#N
[H][C@]12[C@@H](OC(=O)c3ccccc3)[C@@H](C)C[C@]1(OC(C)=O)[C@@H](OC(C)=O)[C@]1(C)OC[C@@]3([C@@H]2OC(C)=O)C(=O)C=C[C@@H]([C@@]13[H])C(C)(C)OC(C)=O |r,c:40|
[H][C@]12[C@@H](OC(=O)CC)[C@@H](C)C[C@]1(OC(C)=O)[C@@H](OC(C)=O)[C@]1(C)OC[C@@]3([C@@H]2OC(C)=O)C(=O)C=C[C@@H]([C@@]13[H])C(C)(C)OC(C)=O |r,c:35|
[H][C@]12[C@@H](OC(=O)C(C)C)[C@@H](C)C[C@]1(OC(C)=O)[C@@H](OC(C)=O)[C@]1(C)OC[C@@]3([C@@H]2OC(C)=O)C(=O)C=C[C@@H]([C@@]13[H])C(C)(C)OC(C)=O |r,c:36|
[H][C@@]12C[C@](C)(OC(C)=O)[C@]1([H])[C@@]1([H])[C@@]3(C)OC[C@@]1([C@H](OC(C)=O)[C@@]1([H])[C@@H](OC(=O)C(C)C)[C@@H](C)C[C@]1(OC(C)=O)[C@H]3OC(C)=O)C(=O)[C@@H]2OC(C)=O |r|
[H][C@@]12C[C@](C)(OC(C)=O)[C@]1([H])[C@@]1([H])[C@@]3(C)OC[C@@]1([C@H](OC(C)=O)[C@@]1([H])[C@@H](OC(=O)c4cccnc4)[C@@H](C)C[C@]1(OC(C)=O)[C@H]3OC(C)=O)C(=O)[C@@H]2OC(=O)C(C)CC |r|
CC(C)c1cc(NC(=O)Nc2cccc(Cl)c2)n(Cc2ccccc2)n1
Fc1ccc(NC(=O)Nc2cc(nn2Cc2ccccc2)C2CC2)cc1Cl
Fc1ccc(NC(=O)Nc2cc(nn2Cc2ccccc2)C2CC2)cc1
Cc1ccc(NC(=O)Nc2cc(nn2Cc2ccccc2)C2CC2)cc1
Brc1cccc(NC(=O)Nc2cc(nn2Cc2ccccc2)C2CC2)c1
Fc1cccc(NC(=O)Nc2cc(nn2Cc2ccccc2)C2CC2)c1
FC(F)(F)c1cccc(NC(=O)Nc2cc(nn2Cc2ccccc2)C2CC2)c1
Clc1cccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2CC2)c1
Fc1ccc(NC(=O)Nc2cc(nn2-c2ccccc2)C(F)(F)F)cc1F
Fc1ccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2CCC2)cc1F
Fc1ccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2CC2)cc1F
Fc1ccc(NC(=O)Nc2cc(nn2-c2ccccc2)-c2ccccc2)cc1F
Cc1cc(NC(=O)Nc2ccc(F)c(F)c2)n(n1)-c1ccncc1
Cc1cc(NC(=O)Nc2ccc(F)c(F)c2)n(Cc2ccccc2)n1
Cc1cc(NC(=O)Nc2ccc(F)c(F)c2)n(n1)-c1ccccn1
Cc1cc(NC(=O)Nc2ccc(F)c(F)c2)n(n1)-c1ccc(F)cc1
Cc1cc(NC(=O)Nc2ccc(F)c(F)c2)n(CC(F)(F)F)n1
Cc1cc(NC(=O)Nc2ccc(F)c(F)c2)n(n1)-c1ccccc1
Cc1cc(NC(=O)Nc2ccccc2)n(n1)-c1ccccc1
Fc1ccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2CCC2)cc1Cl
Brc1cccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2CCC2)c1
FC(F)(F)c1cccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2CCC2)c1
Clc1cccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2CCC2)c1
Clc1cccc(NC(=O)Nc2cc(CC3CC3)nn2-c2ccccc2)c1
Fc1ccc(NC(=O)Nc2cc(CC3CC3)nn2-c2ccccc2)cc1Cl
Fc1ccc(NC(=O)Nc2cc(CC3CC3)nn2-c2ccccc2)cc1
FC(F)(F)c1cccc(NC(=O)Nc2cc(CC3CC3)nn2-c2ccccc2)c1
Fc1cccc(NC(=O)Nc2cc(CC3CC3)nn2-c2ccccc2)c1
Cc1cccc(NC(=O)Nc2cc(CC3CC3)nn2-c2ccccc2)c1
CC(C)c1cc(NC(=O)Nc2ccc(C)cc2)n(n1)-c1ccccc1
CC(C)c1cc(NC(=O)Nc2cccc(C)c2)n(n1)-c1ccccc1
CC(C)c1cc(NC(=O)Nc2cccc(F)c2)n(n1)-c1ccccc1
CC(C)c1cc(NC(=O)Nc2cccc(c2)C(F)(F)F)n(n1)-c1ccccc1
CSc1cccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2CC2)c1
Fc1cccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2CC2)c1
Cc1cccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2CC2)c1
Fc1ccc(NC(=O)Nc2cc(CC3CC3)nn2-c2ccccc2)cc1F
Fc1ccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2CCCC2)cc1F
CC(C)c1cc(NC(=O)Nc2ccc(F)c(F)c2)n(n1)-c1ccccc1
CN(C)S(=O)(=O)c1cc(NC(=O)Cc2ccccc2Br)ccc1C
CN(C)S(=O)(=O)c1cc(NC(=O)Cc2ccccc2Cl)ccc1C
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2Oc3cc(c4c(c3)O[C@@H](CC4=O)c5ccc(cc5)O)O)CO)O)O)O)O)O
CN(C)S(=O)(=O)c1cc(NC(=O)Cc2ccc(F)cc2)ccc1C
CN(C)S(=O)(=O)c1cccc(NC(=O)Cc2ccc(Cl)cc2)c1
CN(C)S(=O)(=O)c1cccc(NC(=O)Cc2ccccc2Cl)c1
Cc1cccc(NC(=O)Cc2ccccc2Cl)c1
FC(F)(F)c1ccc(NC(=O)Cc2ccccc2Cl)cc1
Clc1cccc(NC(=O)Cc2ccccc2Cl)c1
Clc1ccc(NC(=O)Cc2ccccc2Cl)cc1
FC(F)(F)c1cc(NC(=O)Cc2ccccc2Cl)ccc1Cl
FC(F)(F)c1cc(Cl)cc(NC(=O)Cc2ccccc2Cl)c1
FC(F)Oc1cccc(NC(=O)Cc2ccccc2Cl)c1
CC(C)(C)c1cccc(NC(=O)Cc2ccccc2Cl)c1
CS(=O)(=O)c1cc(NC(=O)Cc2ccccc2Cl)ccc1F
CN(C)S(=O)(=O)c1cc(NC(=O)Nc2cccc(c2)C#N)ccc1C
COc1ccc(OC)c(NC(=O)Nc2ccc(C)c(c2)S(=O)(=O)N(C)C)c1
CN(C)S(=O)(=O)c1cc(NC(=O)Nc2ccc(cc2)C(F)(F)F)ccc1C
CN(C)S(=O)(=O)c1cc(NC(=O)Nc2ccccc2Cl)ccc1C
CN(C)S(=O)(=O)c1cc(NC(=O)Nc2cccc(F)c2)ccc1C
CN(C)S(=O)(=O)c1cc(NC(=O)Nc2ccccc2F)ccc1C
COc1ccc(NC(=O)Nc2ccc(C)c(c2)S(=O)(=O)N(C)C)cc1
CN(C)S(=O)(=O)c1cc(NC(=O)Nc2ccc(C)c(Cl)c2)ccc1C
CN(C)S(=O)(=O)c1cc(NC(=O)Nc2ccc(Cl)cc2)ccc1C
CN(C)S(=O)(=O)c1cc(NC(=O)Nc2ccccc2)ccc1C
[H][C@@]12\C=C(C)\[C@@H](C[C@@H](OC(C)=O)C(C)(C)\C=C\[C@H](C)[C@H](OC(C)=O)[C@@]1(O)C[C@H](C)[C@@H]2OC(=O)c1ccccc1)OC(C)=O |r,c:2,t:15|
[H][C@@]12C[C@@H](C)[C@@]34C=C(C)[C@H](OC(=O)C(\C)=C/C)[C@@]3(O)[C@H](O)C(C)=C[C@]([H])(C4=O)[C@]1([H])C2(C)C |r,c:23,t:6|
[H][C@@]12\C=C(C)\[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)C(C)(C)\C=C\[C@H](C)[C@H](O)[C@]1(C[C@H](C)[C@@H]2OC(=O)c1ccccc1)OC(C)=O |r,c:2,t:23|
[H][C@@]12\C=C(C)\[C@H](OC(=O)C(\C)=C\C)[C@H](OC(C)=O)[C@@H](OC(C)=O)C(C)(C)\C=C\[C@H](C)[C@H](OC(C)=O)[C@@]1(O)C[C@H](C)[C@@H]2OC(=O)c1ccccc1 |r,c:2,t:26|
[H][C@@]12\C=C(C)\[C@@H](C[C@@H](OC(C)=O)C(C)(C)\C=C\[C@H](C)[C@H](OC(C)=O)[C@@]1(O)C[C@H](C)[C@@H]2OC(=O)c1ccccc1)OC(=O)C(\C)=C\C |r,c:2,t:15|
[H][C@@]12\C=C(C)\[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)C(C)(C)\C=C\[C@H](C)[C@H](OC(C)=O)[C@@]1(O)C[C@H](C)[C@@H]2OC(=O)c1ccccc1 |r,c:2,t:23|
[H][C@@]12C[C@@H](C)[C@@]34C=C(C)[C@H](OC(=O)C(\C)=C/C)[C@@]3(O)[C@H](O)C(C)=C[C@]([H])(C4=O)[C@]1([H])C2(C)COC(=O)C(\C)=C/C |r,c:23,t:6|
Clc1ccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2CCCC2)cc1
Cc1cc(NC(=O)Nc2cc(nn2-c2ccccc2)C2(C)CC2)ccc1F
CC1CC1c1cc(NC(=O)Nc2ccccc2Br)n(n1)-c1ccccc1
COc1ccc(NC(=O)Nc2cc(nn2Cc2ccccc2)C2CC2C)cc1
Fc1ccc(NC(=O)Nc2cc(nn2Cc2ccccc2)C2CC2(F)F)cc1F
CC1CC1c1cc(NC(=O)Nc2cccc(Cl)c2)n(Cc2ccccc2)n1
CC1CC1c1cc(NC(=O)Nc2cccc(F)c2)n(n1)-c1ccccc1
FC(F)(F)c1ccc(NC(=O)Nc2cc(nn2Cc2ccccc2)C2CC2(F)F)cc1
CC1(CC1)c1cc(NC(=O)Nc2ccc(F)c(F)c2)n(n1)-c1ccccc1
CC1CC1c1cc(NC(=O)Nc2ccc(F)c(F)c2)n(n1)-c1ccccc1
CC1CC1c1cc(NC(=O)Nc2cccc(Cl)c2)n(n1)-c1ccccc1
CC1CC1c1cc(NC(=O)Nc2cccc(Br)c2)n(n1)-c1ccccc1
CC1CC1c1cc(NC(=O)Nc2cccc(F)c2)n(Cc2ccccc2)n1
CC1CC1c1cc(NC(=O)Nc2ccc(F)c(Cl)c2)n(Cc2ccccc2)n1
CC1CC1c1cc(NC(=O)Nc2ccc(F)c(C)c2)n(Cc2ccccc2)n1
CC1CC1c1cc(NC(=O)Nc2ccc(Cl)cc2)n(Cc2ccccc2)n1
COc1ccc(NC(=O)Nc2cc(nn2Cc2ccccc2)C2CC2(F)F)cc1
Cc1ccc(NC(=O)Nc2cc(nn2Cc2ccccc2)C2CC2(F)F)cc1
CC1CC1c1cc(NC(=O)Nc2ccc(C)cc2)n(CC(F)(F)F)n1
CC1CC1c1cc(NC(=O)Nc2ccc(cc2)C(F)(F)F)n(CC(F)(F)F)n1
CC1CC1c1cc(NC(=O)Nc2cccc(F)c2)n(CC(F)(F)F)n1
Fc1cccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2CCCC2)c1
COc1ccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2CCCC2)cc1
COc1ccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2CC2(F)F)cc1
FC(F)(F)c1ccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2CC2(F)F)cc1
FC(F)(F)C1(CC1)c1cc(NC(=O)Nc2ccccc2Cl)n(n1)-c1ccccc1
FC(F)(F)c1cccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2(CC2)C(F)(F)F)c1
FC(F)(F)c1ccccc1NC(=O)Nc1cc(nn1-c1ccccc1)C1(CC1)C(F)(F)F
FC(F)(F)C1(CC1)c1cc(NC(=O)Nc2cccc(Br)c2)n(n1)-c1ccccc1
CC1(CC1)c1cc(NC(=O)Nc2cccc(F)c2)n(n1)-c1ccccc1
Cc1ccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2(C)CC2)cc1
Brc1ccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2CCCC2)cc1
CC1(CC1)c1cc(NC(=O)Nc2ccc(Br)cc2)n(n1)-c1ccccc1
CC1CC1c1cc(NC(=O)Nc2ccc(F)cc2)n(n1)-c1ccccc1
CC1CC1c1cc(NC(=O)Nc2ccc(Cl)cc2)n(n1)-c1ccccc1
CC1CC1c1cc(NC(=O)Nc2cccc(Br)c2)n(Cc2ccccc2)n1
CC1CC1c1cc(NC(=O)Nc2cccc(c2)C(F)(F)F)n(Cc2ccccc2)n1
CC1CC1c1cc(NC(=O)Nc2ccc(Cl)cc2)n(CC(F)(F)F)n1
Cc1ccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2CCCC2)cc1
Cc1cc(NC(=O)Nc2cc(nn2-c2ccccc2)C2CC2(F)F)ccc1F
FC(F)(F)C1(CC1)c1cc(NC(=O)Nc2cc(Cl)cc(Cl)c2)n(n1)-c1ccccc1
Cc1cccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2(C)CC2)c1
COc1ccccc1NC(=O)Nc1cc(nn1-c1ccccc1)C1(CC1)C(F)(F)F
FC1(F)CC1c1cc(NC(=O)Nc2ccc(Cl)cc2)n(Cc2ccccc2)n1
FC(F)(F)C1(CC1)c1cc(NC(=O)Nc2ccccc2Br)n(n1)-c1ccccc1
CC1CC1c1cc(NC(=O)Nc2ccc(Br)cc2)n(n1)-c1ccccc1
Fc1cccc(NC(=O)Nc2cc(nn2Cc2ccccc2)C2CC2(F)F)c1
CC1CC1c1cc(NC(=O)Nc2ccc(F)c(C)c2)n(CC(F)(F)F)n1
CC1CC1c1cc(NC(=O)Nc2ccc(F)c(F)c2)n(CC(F)(F)F)n1
Cc1cc(NC(=O)Nc2cc(nn2-c2ccccc2)C2(CC2)C(F)(F)F)ccc1F
CSc1ccc(NC(=O)Nc2cc(nn2Cc2ccccc2)C2CC2(F)F)cc1
FC1(F)CC1c1cc(NC(=O)Nc2ccc(Br)cc2)n(Cc2ccccc2)n1
Cc1ccc(NC(=O)Nc2cc(nn2-c2ccccc2)C2CC2(F)F)cc1
CC1(CC1)c1cc(NC(=O)Nc2ccc(cc2)C(F)(F)F)n(n1)-c1ccccc1
CC[C@H](C)[C@@H]1NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]2CSSC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)[C@H](CSSC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)C(=O)N[C@@H](CC(N)=O)C(=O)N2)NC(=O)[C@H](CCSC)NC(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H](NC1=O)[C@@H](C)CC)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(N)=O |r|
CCCN(CCC)[C@@H]([C@H](N(CCC)C[C@H](O)CO)c1ccccn1)c1ccccn1 |r|
COc1ccc(cc1)-c1nnn(CC(=O)Nc2cc(C)nn2C2CCCCC2)n1
Cc1cc(NC(=O)Cc2coc(n2)-c2ccccc2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2nnc(n2)-c2ccccc2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2nnc(n2)-c2ccccc2)n(n1)C1CC1
Cc1cc(NC(=O)Cn2nnc(n2)-c2ccccc2)n(n1)-c1ccccc1
Cc1cc(NC(=O)Cn2nnc(n2)-c2cc(Cl)cc(Cl)c2)n(n1)C1CCCCC1
O=C(Cn1nnc(n1)-c1ccccc1)NC1CC2CCC1C2
Cc1cc(NC(=O)Cn2nnc(n2)-c2ccccc2)n(n1)C1CCC(F)(F)CC1
CC(C)n1nc(C)cc1NC(=O)Cn1nnc(n1)-c1ccccc1
Cc1cc(NC(=O)Cn2nnc(n2)-c2ccccc2)n(CC(F)(F)F)n1
Cc1cc(NC(=O)Cn2nnc(n2)-c2ccccc2)n(n1)C1CCCC1
Cc1cc(NC(=O)Cn2nnc(n2)-c2ccccc2)n(n1)C1CCS(=O)(=O)C1
O=C(Cn1nnc(n1)-c1ccccc1)Nc1cc(nn1C1CCCCC1)C1CC1
Cc1cc(NC(=O)Cn2nnc(n2)-c2ccccc2)n(CC2CCCCC2)n1
Cc1cc(NC(=O)Cn2nnc(n2)-c2ccccn2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2nnc(n2)-c2cccc(Cl)c2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2nnc(n2)-c2ccc(Cl)c(Cl)c2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2nnc(n2)-c2cccc(F)c2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2nnc(n2)-c2ccccc2F)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2nnc(n2)-c2ccnc(F)c2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2nnc(n2)-c2cccc(F)n2)n(n1)C1CCCCC1
COc1cccc(c1)-c1nnn(CC(=O)Nc2cc(C)nn2C2CCCCC2)n1
Cc1cc(NC(=O)Cn2nnc(n2)-c2ccc(cc2)C(F)(F)F)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2nnc(n2)-c2cccc(c2)C(F)(F)F)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2nnc(n2)-c2ccc(Cl)c(C)c2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2nncc2-c2ccccc2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cc2ncc(o2)-c2ccccc2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cc2csc(n2)-c2ccccc2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cc2cccc(c2)-c2ccccc2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cc2ccc(cc2)-c2ccccc2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2nnc(n2)-c2cccc(c2)C#N)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2cc(cn2)-c2ccccc2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2nnc(n2)-c2ccccc2)n(n1)C1CCOCC1
Cc1cc(NC(=O)Cn2nnc(n2)-c2ccccc2)n(Cc2ccccc2)n1
Cc1cc(NC(=O)Cn2nnc(n2)-c2cccc(C)c2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cc2nnc(s2)-c2ccccc2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2nnc(n2)-c2ccc(C)cc2)n(n1)C1CCCCC1
Cc1cc(NC(=S)Cn2nnc(n2)-c2ccccc2)n(n1)C1CCCCC1
CCC(C)n1nc(C)cc1NC(=O)Cn1nnc(n1)-c1ccccc1
CC1CC1c1cc(NC(=O)Cn2nnc(n2)-c2ccccc2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2nnc(n2)-c2cccnc2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2nnc(n2)-c2ccc(F)cc2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2nnc(n2)-c2ccc(F)c(F)c2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2nnc(n2)C2CC2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2cc(nn2)-c2ccccc2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cn2ccc(n2)-c2ccccc2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cc2ccc(cc2)-c2ccc(Cl)c(Cl)c2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cc2ccc(F)c(Cl)c2)n(n1)C1CCCCC1
Cc1cc(NC(=O)Cc2ccc(F)c(Cl)c2)n(n1)C1CCS(=O)(=O)C1
Cc1cc(NC(=O)COc2ccc(Cl)cc2Cl)n(n1)C1CCS(=O)(=O)C1
Cc1cc(NC(=O)COc2ccccc2Cl)n(n1)C1CCS(=O)(=O)C1
Cc1cc(NC(=O)COc2ccc(Cl)cc2)n(n1)C1CCS(=O)(=O)C1
Cc1cc(NC(=O)COc2cccc(Cl)c2Cl)n(n1)C1CCS(=O)(=O)C1
Cc1cc(NC(=O)COc2cc(Cl)ccc2Cl)n(n1)C1CCS(=O)(=O)C1
Cc1cc(NC(=O)COc2ccc(Br)cc2Cl)n(n1)C1CCS(=O)(=O)C1
Cc1cc(NC(=O)COc2ccc(F)cc2Cl)n(n1)C1CCS(=O)(=O)C1
Cc1cc(NC(=O)COc2ccc(Cl)cc2F)n(n1)C1CCS(=O)(=O)C1
Cc1cc(NC(=O)COc2ccc(Br)cc2Br)n(n1)C1CCS(=O)(=O)C1
Cc1cc(NC(=O)COc2ccccc2Br)n(n1)C1CCS(=O)(=O)C1
Cc1cc(NC(=O)COc2ccc(Br)cc2)n(n1)C1CCS(=O)(=O)C1
Cc1cc(NC(=O)COc2cc(F)ccc2F)n(n1)C1CCS(=O)(=O)C1
Cc1cc(NC(=O)COc2ccc(C)cc2C)n(n1)C1CCS(=O)(=O)C1
Cc1cc(NC(=O)COc2ccc(cc2C(F)(F)F)C(F)(F)F)n(n1)C1CCS(=O)(=O)C1
Cc1cc(NC(=O)COc2ccccc2C(F)(F)F)n(n1)C1CCS(=O)(=O)C1
Cc1cc(NC(=O)COc2ccc3ccccc3c2)n(n1)C1CCS(=O)(=O)C1
Cc1cc(NC(=O)COc2cnc(Cl)cc2Cl)n(n1)C1CCS(=O)(=O)C1
Cc1cc(NC(=O)COc2ccc(Cl)nc2Cl)n(n1)C1CCS(=O)(=O)C1
Cc1cc(NC(=O)CNc2ccc(Cl)cc2Cl)n(n1)C1CCS(=O)(=O)C1
CN(CC(=O)Nc1cc(C)nn1C1CCS(=O)(=O)C1)c1ccc(Cl)cc1Cl
CCc1cc(NC(=O)COc2ccc(Cl)cc2Cl)n(n1)C1CCS(=O)(=O)C1
Cc1nonc1NC(=O)COc1ccc(Cl)cc1Cl
CN(C(=O)COc1ccc(Cl)cc1Cl)c1cc(C)nn1C1CCCCC1
CC(C)n1nc(C)cc1NC(=O)COc1ccc(Cl)cc1Cl
Cc1cc(NC(=O)COc2ccc(Cl)cc2Cl)n(n1)C1CCS(=O)(=O)CC1
Cc1cc(NC(=O)COc2ccc(Cl)cc2Cl)n(n1)C1CCCCC1
Cc1cc(NC(=O)COc2ccc(Cl)cc2Cl)n(n1)C1CCC(F)(F)CC1
Cc1cc(NC(=O)COc2ccc(Cl)cc2Cl)n(n1)C1CCOCC1
OC[C@@H](O)COc1ncc(Cl)c2n(c(CO)cc(=O)c12)-c1c(Cl)cccc1Cl |r,wD:2.2,(-3.78,-7.53,;-4.55,-6.2,;-3.46,-5.11,;-2.12,-5.88,;-3.46,-3.57,;-2.12,-2.8,;-2.12,-1.26,;-3.46,-.49,;-3.46,1.05,;-2.12,1.82,;-2.12,3.36,;-.79,1.05,;.54,1.82,;1.88,1.05,;3.21,1.82,;4.55,1.05,;1.88,-.49,;.54,-1.26,;.54,-2.8,;-.79,-.49,;.54,4.45,;-.79,5.22,;-2.12,4.45,;-.79,6.76,;.54,7.53,;1.88,6.76,;1.88,5.22,;3.21,4.45,)|
OCC(CO)Oc1ncc(Cl)c2n(c(CO)cc(=O)c12)-c1c(Cl)cccc1Cl |(-5.33,-4.46,;-4,-3.69,;-2.67,-4.46,;-2.67,-6,;-4,-6.77,;-1.33,-3.69,;-1.33,-2.15,;-2.67,-1.38,;-2.67,.16,;-1.33,.93,;-1.33,2.47,;,.16,;1.33,.93,;2.67,.16,;4,.93,;5.33,.16,;2.67,-1.38,;1.33,-2.15,;1.33,-3.69,;,-1.38,;1.33,3.69,;,4.46,;-1.33,3.69,;,6,;1.33,6.77,;2.67,6,;2.67,4.46,;4,3.69,)|
CSc1c(C#N)c(=O)c2ccc(F)cc2n1-c1c(Cl)cccc1Cl |(4.67,-.77,;3.33,0,;2,-.77,;2,-2.31,;3.33,-3.08,;4.67,-3.85,;.66,-3.08,;.66,-4.62,;-.67,-2.31,;-1.99,-3.08,;-3.33,-2.31,;-3.33,-.77,;-4.67,0,;-2,0,;-.67,-.77,;.66,0,;.66,1.54,;-.67,2.31,;-2,1.54,;-.67,3.85,;.67,4.62,;2,3.85,;2,2.32,;3.34,1.55,)|
Cc1cc(=O)c2c(F)cncc2n1-c1c(Cl)cc(cc1Cl)C#N |(3.33,-1.54,;2,-2.31,;2,-3.85,;.66,-4.62,;.66,-6.16,;-.67,-3.85,;-2,-4.62,;-2,-6.16,;-3.33,-3.86,;-3.33,-2.31,;-2,-1.54,;-.67,-2.31,;.66,-1.54,;.66,0,;-.67,.77,;-2.01,0,;-.67,2.31,;.66,3.08,;1.99,2.31,;2,.78,;3.33,.01,;.66,4.62,;.66,6.16,)|
Cc1cc(=O)c2c(F)cncc2n1-c1c(Cl)cc(cc1Cl)C#CCO |(3.33,-2.69,;2,-3.46,;2,-5,;.66,-5.77,;.66,-7.31,;-.67,-5,;-2,-5.77,;-2,-7.31,;-3.33,-5.01,;-3.33,-3.46,;-2,-2.69,;-.67,-3.46,;.66,-2.69,;.66,-1.15,;-.67,-.38,;-2.01,-1.15,;-.67,1.15,;.66,1.92,;1.99,1.16,;2,-.38,;3.33,-1.15,;.66,3.46,;.66,5,;.66,6.54,;-.67,7.31,)|
Cc1cc(=O)c2c(F)cncc2n1-c1c(Cl)cc(cc1Cl)C#CCN1CCOCC1 |(3.33,-3.85,;2,-4.62,;2,-6.16,;.66,-6.93,;.66,-8.47,;-.67,-6.16,;-2,-6.93,;-2,-8.47,;-3.33,-6.16,;-3.33,-4.62,;-2,-3.85,;-.67,-4.62,;.66,-3.85,;.66,-2.31,;-.67,-1.54,;-2,-2.31,;-.67,-0,;.66,.77,;1.99,0,;2,-1.53,;3.34,-2.3,;.66,2.31,;.66,3.85,;.66,5.39,;-.67,6.16,;-2,5.39,;-3.34,6.16,;-3.34,7.7,;-2,8.47,;-.67,7.7,)|
COc1cc(Cl)c(c(Cl)c1)-n1c(C)cc(=O)c2c(F)cncc12 |(-.67,5.77,;.66,5,;.66,3.46,;-.67,2.69,;-.67,1.16,;-2.01,.39,;.66,.39,;2,1.16,;3.33,.39,;1.99,2.7,;.66,-1.15,;2,-1.92,;3.33,-1.15,;2,-3.46,;.66,-4.23,;.66,-5.77,;-.67,-3.46,;-2,-4.23,;-2,-5.77,;-3.33,-3.47,;-3.33,-1.92,;-2,-1.15,;-.67,-1.92,)|
Cc1cc(=O)c2c(F)cncc2n1-c1c(Cl)cc(OCC(O)CO)cc1Cl |(3.33,-3.08,;2,-3.85,;2,-5.39,;.66,-6.16,;.66,-7.7,;-.67,-5.39,;-2,-6.16,;-2,-7.7,;-3.33,-5.4,;-3.33,-3.85,;-2,-3.08,;-.67,-3.85,;.66,-3.08,;.66,-1.54,;-.67,-.77,;-2.01,-1.54,;-.67,.77,;.66,1.54,;.66,3.08,;-.67,3.85,;-.67,5.39,;.66,6.16,;-2,6.16,;-2,7.7,;1.99,.77,;2,-.76,;3.33,-1.53,)|
Cc1cc(=O)c2c(OCC(O)CO)nc(cc2n1-c1c(Cl)cccc1Cl)N1CCOCC1 |(5.33,2.31,;4,1.54,;4,0,;2.66,-.77,;2.66,-2.31,;1.33,0,;0,-.77,;0,-2.31,;1.34,-3.08,;1.34,-4.62,;0,-5.39,;2.67,-5.39,;2.67,-6.93,;-1.33,-.01,;-1.33,1.54,;-0,2.31,;1.33,1.54,;2.66,2.31,;2.66,3.85,;1.33,4.62,;-.01,3.85,;1.33,6.16,;2.66,6.93,;3.99,6.16,;4,4.62,;5.34,3.85,;-2.67,2.31,;-4,1.54,;-5.34,2.31,;-5.34,3.85,;-4,4.62,;-2.67,3.85,)|
COc1ncc(Cl)c2n(c(CO)cc(=O)c12)-c1c(Cl)cccc1Cl |(-1.33,-5,;-2.66,-4.23,;-2.66,-2.69,;-4,-1.93,;-4,-.38,;-2.67,.39,;-1.89,1.72,;-1.34,-.38,;-0,.39,;1.33,-.38,;2.66,.39,;4,-.38,;1.33,-1.92,;-0,-2.69,;-0,-4.23,;-1.34,-1.92,;-0,1.93,;-1.34,2.7,;-2.67,1.93,;-1.33,4.23,;-0,5,;1.33,4.24,;1.34,2.7,;2.67,1.93,)|
COc1ncc(C)c2n(c(CO)cc(=O)c12)-c1c(Cl)cccc1Cl |(-1.33,-5,;-2.66,-4.23,;-2.66,-2.69,;-4,-1.93,;-4,-.38,;-2.66,.38,;-1.89,1.72,;-1.34,-.38,;-0,.39,;1.33,-.38,;2.66,.39,;4,-.38,;1.33,-1.92,;-0,-2.69,;-0,-4.23,;-1.34,-1.92,;-0,1.93,;-1.34,2.7,;-2.67,1.93,;-1.33,4.23,;-0,5,;1.33,4.24,;1.34,2.7,;2.67,1.93,)|
Cc1cc(=O)c2c(OCCOCCOCCOCCO)ncc(Cl)c2n1-c1c(Cl)cccc1Cl |(12.06,-4.58,;10.73,-3.81,;9.39,-4.58,;8.06,-3.81,;6.73,-4.58,;8.06,-2.27,;6.73,-1.5,;5.39,-2.27,;4.06,-1.5,;2.72,-2.27,;1.39,-1.5,;.06,-2.27,;-1.28,-1.5,;-2.61,-2.27,;-3.94,-1.5,;-5.28,-2.27,;-6.61,-1.5,;-7.94,-2.27,;-9.28,-1.5,;-10.61,-2.27,;6.73,.04,;8.06,.81,;9.39,.04,;10.73,.81,;9.39,-1.5,;10.73,-2.27,;12.06,-1.5,;13.39,-2.27,;13.39,-3.81,;14.73,-1.5,;14.73,.04,;13.39,.81,;12.06,.04,;11.43,1.45,)|
Cc1cc(=O)c2c(OCC(O)CC(O)CO)ncc(Cl)c2n1-c1c(Cl)cccc1Cl |(3.33,3.47,;2,2.7,;2,1.16,;.66,.39,;.66,-1.15,;-.67,1.16,;-2,.39,;-2,-1.15,;-.66,-1.92,;-.66,-3.46,;-2,-4.23,;.67,-4.23,;.67,-5.77,;-.66,-6.54,;2,-6.54,;2,-8.08,;-3.33,1.15,;-3.33,2.7,;-2,3.47,;-1.23,4.8,;-.67,2.7,;.66,3.47,;.66,5.01,;-.67,5.78,;-2.01,5.01,;-.67,7.31,;.66,8.08,;1.99,7.32,;2,5.78,;3.33,5.01,)|
Cc1cc(=O)c2c(OCC(O)COCC(O)CO)ncc(Cl)c2n1-c1c(Cl)cccc1Cl |(3.33,.95,;2,.18,;2,-1.36,;.67,-2.13,;.67,-3.67,;-.67,-1.36,;-2,-2.13,;-2,-3.67,;-3.33,-4.44,;-3.33,-5.98,;-4.67,-6.75,;-2,-6.75,;-.67,-5.98,;.67,-6.75,;2,-5.98,;2,-4.44,;3.33,-6.75,;4.67,-5.98,;-3.33,-1.36,;-3.33,.18,;-2,.95,;-2,2.49,;-.67,.18,;.67,.95,;.67,3.67,;-.67,4.44,;-2,3.67,;-.67,5.98,;.67,6.75,;2,5.98,;2,4.44,;3.33,3.67,)|
Cc1cc(=O)c2c(OCCO)ncc(Cl)c2n1-c1c(Cl)cccc1Cl |(4,1.07,;2.67,.3,;2.67,-1.24,;1.33,-2.01,;1.33,-3.55,;,-1.24,;-1.33,-2.01,;-1.33,-3.55,;-2.67,-4.32,;-2.67,-5.86,;-4,-6.63,;-2.67,-1.24,;-2.67,.3,;-1.33,1.07,;-1.33,2.61,;,.3,;1.33,1.07,;1.33,3.55,;2.67,4.32,;4,3.55,;2.67,5.86,;1.33,6.63,;,5.86,;,4.32,;-1.33,3.55,)|
OCC(O)COc1ncc(Cl)c2n(c(CO)cc(=O)c12)-c1c(Cl)cccc1Cl |(-3.78,-7.53,;-4.55,-6.2,;-3.46,-5.11,;-2.12,-5.88,;-3.46,-3.57,;-2.12,-2.8,;-2.12,-1.26,;-3.46,-.49,;-3.46,1.05,;-2.12,1.82,;-2.12,3.36,;-.79,1.05,;.54,1.82,;1.88,1.05,;3.21,1.82,;4.55,1.05,;1.88,-.49,;.54,-1.26,;.54,-2.8,;-.79,-.49,;.54,4.45,;-.79,5.22,;-2.12,4.45,;-.79,6.76,;.54,7.53,;1.88,6.76,;1.88,5.22,;3.21,4.45,)|
OC[C@H](O)COc1ncc(Cl)c2n(c(CO)cc(=O)c12)-c1c(Cl)cccc1Cl |r,wU:2.2,(-4.27,-7.27,;-4.67,-5.78,;-3.33,-5.01,;-2.25,-6.1,;-3.33,-3.47,;-2,-2.7,;-2,-1.16,;-3.33,-.39,;-3.33,1.15,;-2,1.92,;-2,3.46,;-.67,1.15,;.67,1.92,;2,1.15,;3.33,1.92,;4.67,1.15,;2,-.39,;.67,-1.16,;.67,-2.7,;-.67,-.39,;.67,4.19,;-.67,4.96,;-2,4.19,;-.67,6.5,;.67,7.27,;2,6.5,;2,4.96,;3.33,4.19,)|
CS(=O)(=O)CCCOc1ncc(Cl)c2n(c(CO)cc(=O)c12)-c1c(Cl)cccc1Cl |(-6.66,-5,;-5.33,-4.23,;-4.56,-2.9,;-6.1,-2.9,;-4,-5,;-2.66,-4.23,;-1.33,-5,;0,-4.23,;0,-2.69,;-1.33,-1.93,;-1.33,-.38,;0,.38,;.77,1.72,;1.33,-.38,;2.66,.39,;4,-.38,;5.33,.39,;6.66,-.38,;4,-1.92,;2.66,-2.69,;2.66,-4.23,;1.33,-1.92,;2.66,1.93,;4,2.7,;5.34,1.93,;3.99,4.24,;2.66,5,;1.33,4.23,;1.33,2.7,;-0,1.93,)|