85 SMILES Strings for G-protein coupled receptor 39

Compound Name
SMILES String
C(Nc1cc(ncn1)-c1ccccn1)C1CC1
CC(C)(C)CNc1nc(NCC2CC2)cc(n1)-c1ccccn1
CC(C)(C)c1cc([nH]n1)C(=O)N\N=C\c1ccc(O)cc1O
CC(C)COC1CC(=O)Nc2c1c(C)nn2-c1ncnc2nc[nH]c12
CC(C)Oc1ccc(cc1)C1CC(=O)Nc2c1c(C)nn2-c1ncnc2nc[nH]c12
CC(C)c1ccc(COC2CC(=O)Nc3c2c(C)nn3-c2ncnc3nc[nH]c23)cc1
CC(Nc1cc(C)nc2c(cnn12)-c1ccccn1)c1ccc(F)cc1
CCC(C(=O)NC1CC(=O)Nc2c1c(C)nn2-c1ncnc2nc[nH]c12)c1ccccc1
CCCCCCCCOC1CC(=O)Nc2c1c(C)nn2-c1ncnc2nc[nH]c12
CCc1ncc(CN2C[C@@H]([C@H](C2)c2cccnc2)C(=O)NCc2ccccc2Cl)[nH]1 |r|
CCc1ncc(CN2C[C@H]([C@@H](C2)c2cccnc2)C(=O)NCc2ccccc2Cl)[nH]1 |r|
CN(C(=O)C1CC(=O)Nc2c1c(C)nn2-c1ncnc2nc[nH]c12)c1ccccc1
CN(C(=O)C1CC(=O)Nc2c1c(C)nn2-c1ncnc2nc[nH]c12)c1nccs1
CN(C)c1nc(NCC2CC2)cc(n1)-c1ccccn1
CNC(=O)C(Nc1cc(C)nc2c(cnn12)-c1ccccn1)c1ccc(F)cc1
CNC(=O)c1ccc(CNc2cc(nc(NC)n2)-c2ccccn2)cc1
CNc1cc(nc(NC2CCCCC2)n1)-c1ccccn1
CNc1nc(NC2(CCC2)c2ccc(Cl)cc2)cc(n1)-c1ccccn1
CNc1nc(NC2CCCCC2)cc(n1)-c1ccccn1
CNc1nc(NCC(C)(C)C)cc(n1)-c1ccccn1
CNc1nc(NCC2CC2)cc(n1)-c1ccccn1
CNc1nc(NCC2CCCCC2)cc(n1)-c1ccccn1
CNc1nc(NCc2ccc(Cl)cc2)cc(n1)-c1ccccn1
CNc1nc(NCc2ccc(Cl)cc2Cl)cc(n1)-c1ccccn1
CNc1nc(NCc2ccc(NC(C)=O)cc2)cc(n1)-c1ccccn1
CNc1nc(NCc2ccc(NC(C)=O)cc2F)cc(n1)-c1ccccn1
CNc1nc(NCc2ccc(NS(C)(=O)=O)cc2)cc(n1)-c1ccccn1
CNc1nc(NCc2ccc(NS(C)(=O)=O)cc2Cl)cc(n1)-c1ccccn1
CNc1nc(NCc2ccc(OC(F)(F)F)cc2)cc(n1)-c1ccccn1
CNc1nc(NCc2ccc(cc2)N(C)C(C)=O)cc(n1)-c1ccccn1
CNc1nc(NCc2ccc(cc2)S(C)(=O)=O)cc(n1)-c1ccccn1
CNc1nc(NCc2ccccc2Cl)cc(n1)-c1ccccn1
CNc1nc(NCc2ccncc2)cc(n1)-c1ccccn1
CNc1nc(Oc2ccccc2)cc(n1)-c1ccccn1
COCCNc1nc(NCC2CC2)cc(n1)-c1ccccn1
COc1ccc(CCOC2CC(=O)Nc3c2c(C)nn3-c2ncnc3nc[nH]c23)cc1
COc1ccc(cc1)S(=O)(=O)Nc1c(C)cc(C)cc1C
COc1cccc(c1)[C@@H]1CCN(CCc2ccccc2)C[C@H]1C(=O)NCCc1ccccn1 |r|
C\C(=N/NC(=O)c1cc2ccccc2cc1O)c1ccc(N)cc1
Cc1cc(C)n(CCOC2CC(=O)Nc3c2c(C)nn3-c2ncnc3nc[nH]c23)n1
Cc1cc(N2C(CCC2=O)c2ccccc2)n2ncc(-c3ccccn3)c2n1
Cc1cc(N2CCC(C2)c2ccccc2)n2ncc(-c3ccccn3)c2n1
Cc1cc(N2CCCC2c2ccccc2)n2ncc(-c3ccccn3)c2n1
Cc1cc(N2CCCC2c2cccnc2)n2ncc(-c3ccccn3)c2n1
Cc1cc(NC(C)(C)c2ccc(F)cc2)n2ncc(-c3ccccn3)c2n1
Cc1cc(NCc2ccc(F)cc2)n2ncc(-c3ccccn3)c2n1
Cc1ccnn1CCOC1CC(=O)Nc2c1c(C)nn2-c1ncnc2nc[nH]c12
Cc1nc(NCc2ccc(Cl)cc2)cc(n1)-c1ccccn1
Cc1nn(c2NC(=O)CC(C(=O)NCc3ccc(F)cc3)c12)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(C(=O)NCc3ccc4OCOc4c3)c12)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(C(=O)NCc3ccccc3)c12)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(C(=O)Nc3ccccc3)c12)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(NC(=O)Cc3ccccc3)c12)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(NC(=O)Cc3cccs3)c12)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(NC(=O)c3ccccc3)c12)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(OC(=O)Cc3ccccc3)c12)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(OC(=O)c3ccc(F)cc3)c12)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(OC3CCCC3)c12)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(OCC(=O)c3ccc(F)cc3)c12)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(OCCc3ccccc3)c12)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(OCCn3cccn3)c12)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(OCc3cc(F)cc4COCOc34)c12)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(OCc3ccc(Cl)cc3Cl)c12)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(OCc3ccc(F)cc3)c12)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(OCc3ccc(cc3)C#N)c12)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(OCc3ccccc3C#N)c12)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(OCc3ccccc3Cl)c12)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(OCc3ccccc3F)c12)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(c12)c1ccc(COc2cccc(Cl)c2)cc1)-c1nc(C)cc(C)n1
Cc1nn(c2NC(=O)CC(c12)c1ccc(F)cc1Cl)-c1ncnc2nc[nH]c12
Cc1nn(c2NC(=O)CC(c12)c1ccc(F)cc1F)-c1nc(C)cc(C)n1
Cc1nn(c2NC(=O)CC(c12)c1ccc(F)cc1F)-c1ncnc2nc[nH]c12
Cc1noc(C)c1COC1CC(=O)Nc2c1c(C)nn2-c1ncnc2nc[nH]c12
Clc1ccc2nc(CN3CCN(CC3)c3ccc(cn3)C#N)cn2c1
Cn1c2NC(N\N=C\c3ccc(O)cc3O)N(CC=C)c2c(=O)n(C)c1=O
Cn1cc(cn1)-c1ccc2nc([nH]c(=O)c2c1)C(N)CCOCc1ccccc1
FC(F)(F)CNc1nc(NCc2ccc(Cl)cc2)cc(n1)-c1ccccn1
FC(F)(F)Oc1ccc(CNc2nc(NCC3CC3)cc(n2)-c2ccccn2)cc1
Fc1cccc(c1)S(=O)(=O)NC[C@H]1CC[C@H](CNc2cc(nc(NC3CC3)n2)-c2ccccn2)CC1 |r,wU:12.12,wD:15.16,(-.16,-17.24,;1.18,-16.47,;1.18,-14.92,;2.52,-14.16,;3.85,-14.93,;3.83,-16.48,;2.51,-17.24,;5.16,-17.24,;5.92,-18.57,;4.39,-18.57,;6.5,-16.49,;7.83,-17.26,;9.17,-16.5,;9.18,-14.96,;10.51,-14.2,;11.84,-14.97,;13.17,-14.2,;14.5,-14.97,;15.84,-14.2,;15.84,-12.66,;17.18,-11.89,;18.51,-12.66,;18.51,-14.19,;19.85,-14.96,;21.18,-14.19,;22.71,-14.17,;21.94,-12.84,;17.17,-14.97,;17.17,-10.36,;15.84,-9.59,;15.84,-8.04,;17.17,-7.27,;18.51,-8.04,;18.51,-9.59,;11.84,-16.51,;10.5,-17.27,)|
Fc1cccc(c1)S(=O)(=O)NC[C@H]1CC[C@H](CNc2nc(NC3CC3)cc(n2)-c2ccccn2)CC1 |r,wU:12.12,wD:15.16,(2.07,-15.15,;3.4,-14.39,;3.41,-12.84,;4.74,-12.07,;6.07,-12.85,;6.06,-14.39,;4.73,-15.15,;7.38,-15.16,;8.14,-16.49,;6.61,-16.48,;8.72,-14.4,;10.05,-15.18,;11.39,-14.41,;11.4,-12.87,;12.73,-12.11,;14.06,-12.88,;15.4,-12.11,;16.73,-12.89,;18.06,-12.12,;19.4,-12.89,;20.74,-12.11,;22.07,-12.88,;23.4,-12.1,;24.94,-12.09,;24.16,-10.76,;20.73,-10.57,;19.4,-9.81,;18.06,-10.58,;19.4,-8.27,;18.06,-7.5,;18.07,-5.96,;19.39,-5.19,;20.73,-5.95,;20.74,-7.5,;14.07,-14.42,;12.72,-15.19,)|
NC(Cc1cnc[nH]1)c1nc2ccc(cc2c(=O)[nH]1)-c1ccccc1
O=C(Cc1nn(CC2CCC2)c(=O)c2ccccc12)NCc1ccccn1
OCC(O)\C=N\Nc1nc(Nc2ccccc2)nc(Nc2ccccc2)n1
OCCCN\C=C1\C(=O)N(N=C1c1ccccc1)c1nc2ccccc2s1 |c:10|
[Zn++]