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CHEMBL1088172 | [O][=C][Branch2][Ring1][S][C][C@@H1][C][/C][=C][/C][C][C][C][=Branch1][C][=O][O][C@H1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][C][Ring2][Ring1][Ring2][=O][N][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1] |
CHEMBL1096263 | [C][C][NH1][C][N][=C][Branch1][C][N][NH1][C][=Branch1][C][=O][C][=Ring1][Branch2][C][=Ring1][O][S][C][=N][C][=C][N][Ring1][Branch1][C] |
CHEMBL1086220 | [C][N][Branch1][C][C][C][C][Branch1][C][O][C][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Ring1][#C][=Branch1][C][=O][=O] |
CHEMBL1097664 | [O][=C][Branch1][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][Branch1][C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL1099227 | [C][O][C][=C][C][Branch1][C][O][=C][C][=Branch1][Ring2][=C][Ring1][#Branch1][C@@H1][Branch1][C][O][C@H1][Branch2][Ring1][=Branch1][C][C@H1][Branch1][C][O][C@H1][Branch1][C][O][C@@H1][Branch1][C][O][/C][=C][/C][C@H1][Branch1][C][C][O][O][C][Ring2][Ring1][Branch1][=O] |
CHEMBL1096651 | [C][C][Branch1][C][C][C][C@H1][Branch1][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@H1][Branch2][S][=N][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@H1][Branch2][=Branch2][=Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C@H1][Branch2][Branch1][Ring2][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch2][C][C][=C][N][=C][NH1][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][O][C][Branch1][C][C][C][C@@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][O] |
CHEMBL1096328 | [C][O][C][=C][C][Branch2][Branch1][=N][C][C][=C][N][=C][Branch2][Ring2][#C][/N][=C][\C][=Branch1][C][=O][N][Branch2][Ring1][#Branch1][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Ring2][Ring1][O][N][=C][Ring2][Ring2][C][N][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring2][N][O][C] |
CHEMBL1094608 | [C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=S][N][/N][=C][/C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][#Branch2] |
CHEMBL1085497 | [C][C][C@H1][O][C][=Branch1][C][=O][C@H1][Branch1][C][C][C@@H1][Branch2][Branch1][Ring1][O][C@H1][C][C@@][Branch1][C][C][Branch1][Ring1][O][C][C@@H1][Branch2][Ring1][N][O][C][=Branch1][C][=O][N][C][C][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C@H1][Branch1][C][C][O][Ring2][Ring1][=N][C@H1][Branch1][C][C][C@@H1][Branch2][Ring1][Branch1][O][C@@H1][O][C@H1][Branch1][C][C][C][C@H1][Branch1][=Branch1][N][Branch1][C][C][C][C@H1][Ring1][#Branch2][O][C@][Branch1][C][C][Branch1][Ring1][O][C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][C@H1][Branch1][C][C][C@@H1][Branch1][C][O][C@][Ring2][=Branch1][C][Branch1][C][C][O] |
CHEMBL1076603 | [C][C][C@H1][Branch1][C][C][C@H1][Branch2][=Branch1][=C][N][C][=Branch1][C][=O][C@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C@H1][Branch2][Ring1][Branch2][C][C][=C][C][=C][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][N][C][=Branch1][C][=O][C][N][C][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch2][C][C][=C][N][=C][NH1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O] |
CHEMBL3347277 | [C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][NH1][C][=C][C][Ring1][Branch1][=C][Ring1][=Branch2][=C][N][=C][Ring2][Ring1][C][NH1][Ring2][Ring1][Branch1] |
CHEMBL154993 | [C][C][C][C][C][C][C][C][C][C][C][C][C][C][O][C][=C][C][=C][Branch1][S][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=N+1][Ring1][=Branch1][C][C][=C][Ring1][P].[I-1] |
CHEMBL603145 | [C][C][C][C][C][O][C][=Branch1][C][=O][N][C][C][N][Branch2][Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C][=C][C][Branch2][Ring1][Ring1][N][C][C][C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][C][C][Ring1][N][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][Ring2][Ring1][Branch2][C][C][Ring2][Ring2][=Branch2] |
CHEMBL603154 | [C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=N][C][Branch1][#Branch2][N][C][C][=C][C][=C][O][Ring1][Branch1][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][P].[Cl] |
CHEMBL601104 | [C][C][=C][C][=C][Branch2][Ring2][O][N][C][=C][C][Branch1][C][C][=N][C][Branch2][Ring1][O][N][C][C][N][Branch1][P][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][C][Ring1][S][=N][Ring2][Ring1][#Branch1][C][=C][Ring2][Ring1][=C] |
CHEMBL604009 | [C][C][C][Branch1][Ring1][C][C][C][O][C][=N][C][Branch1][C][N][=C][N][=C][N][Branch1][S][C][O][C@@H1][Branch1][Ring1][C][O][C@H1][Branch1][C][O][C@@H1][Ring1][Branch2][O][C][Ring1][=C][=N][Ring2][Ring1][Ring1] |
CHEMBL601115 | [C][C][=Branch1][C][=O][N][C][S][C][Branch1][C][C][=C][Branch1][C][C][C][=Ring1][#Branch1][N][=N][C][=C][C][=C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][O][C][=C][Ring1][#Branch2] |
CHEMBL1077002 | [C][C][C][C][C@H1][Branch2][Ring2][=Branch2][N][C][=Branch1][C][=O][O][C@@H1][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][C][Ring2][Ring1][C][Branch1][C][C][C][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL1077246 | [C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring2][P][C][S][C][C@@H1][Branch2][Ring1][=Branch1][C][O][C][=Branch1][C][=O][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][O][C][=Branch1][C][=O][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C] |
CHEMBL162443 | [N][=C][Branch1][C][N][N][C][C][C][C][Branch2][Branch1][C][C][C@@H1][Branch2][Ring1][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C@H1][C][C][C][N][Branch1][=Branch1][C][=Branch1][C][=N][N][C][Ring1][=Branch2][O][C][Ring2][Ring2][Ring2].[O][=C][Branch1][C][O][C][Branch1][C][F][Branch1][C][F][F] |
CHEMBL1092453 | [O][=C][Branch1][O][/C][=C][/C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Ring1][=Branch2] |
CHEMBL1077481 | [C][O][C][C@@H1][Branch2][Branch2][=N][C][C][O][C@@][Branch1][C][O][Branch2][#Branch1][=Branch1][C@H1][Branch1][#Branch1][O][C][Branch1][C][C][=O][C][C][C][=Branch1][C][=O][/C][Branch1][C][C][=C][/C][Branch1][C][C][=C][/C][Branch1][C][C][=C][/C@@H1][Branch1][C][C][C@H1][Branch2][Ring1][#Branch2][O][C@@H1][O][C@@H1][Branch1][C][C][C@H1][Branch1][Ring1][O][C][C@@H1][Branch1][C][O][C@@H1][Ring1][#Branch2][O][C][Branch1][C][C][=O][/C][=C][/C][Branch1][C][C][=C][/C][C][C@H1][Branch1][C][O][C@@H1][Branch1][Ring1][O][C][C][Ring2][Ring2][N][C@H1][Branch1][C][C][C@@H1][Branch1][C][O][C@H1][Ring2][Branch1][#Branch2][C][O][C@H1][C][C@][Branch1][C][C][Branch1][C][O][C@@H1][Branch2][Ring1][=Branch2][O][C@H1][C][C@@H1][Branch1][Ring1][O][C][C@H1][Branch1][#Branch1][O][C][Branch1][C][C][=O][C@@H1][Branch1][C][C][O][Ring1][=N][C@H1][Branch1][C][C][O][Ring2][Ring1][#Branch1] |
CHEMBL4116119 | [C][/C][=C][Branch1][Branch2][\C][S][C][=Branch1][C][=N][N][C][=Branch1][C][=O][O][C] |
CHEMBL607490 | [O][=C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][C][O][C][C][C][P][=Branch1][C][=O][Branch1][C][O][O] |
CHEMBL1098347 | [C][C@@H1][O][C@@H1][Branch2][O][=C][O][C@H1][C@H1][Branch2][Branch2][=Branch2][O][C@H1][C][C][C@@][Branch1][C][C][C@@H1][Branch2][#Branch1][Branch1][C][C][C@][Branch1][C][C][C@@H1][Ring1][Branch2][C][C][=C][C@H1][C][C][Branch1][C][C][Branch1][C][C][C][C][C@][Ring1][Branch2][Branch2][Ring2][=C][C][=Branch1][C][=O][O][C@@H1][O][C@H1][Branch2][Ring1][=Branch1][C][O][C@@H1][O][C@H1][Branch1][Ring1][C][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring1][#Branch2][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring2][Ring1][Branch1][O][C][C][C@][Ring2][Ring2][Branch1][Ring2][Ring2][#Branch2][C][C][Ring2][Branch1][Ring2][Branch1][C][C][C][O][C][C@H1][Branch1][C][O][C@@H1][Ring2][Branch1][=C][O][C@@H1][O][C][C@@H1][Branch2][Ring1][Branch1][O][C@@H1][O][C@H1][Branch1][Ring1][C][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring1][#Branch2][O][C@H1][Branch1][C][O][C@H1][Ring2][Ring1][Ring1][O][C@H1][Branch1][C][O][C@H1][Branch1][P][O][C@@H1][O][C][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring1][Branch2][O][C@H1][Ring2][Branch2][Branch1][O] |
CHEMBL1159458 | [C][O][C][=C][C][=C][Branch2][#Branch1][Branch1][C][C][C][=Branch1][C][=O][C][=C][Branch1][C][O][C][=C][Branch2][Branch1][#C][O][C@@H1][O][C@][Branch1][C][C][Branch1][Ring1][C][O][C@@][Branch1][C][C][Branch1][C][O][C@][Branch1][C][C][Branch1][C][O][C@@][Ring1][=N][Branch1][C][C][O][C@][Branch1][C][C][O][C][Branch1][C][C][Branch1][C][C][C@][Branch1][C][C][Branch1][C][O][C@@][Branch1][C][C][Branch1][C][O][C@H1][Ring1][=N][O][C][=C][Ring2][Ring2][Branch1][O][C][=C][Ring2][Ring2][S][O] |
CHEMBL1160371 | [C][C][=C][N][Branch2][N][S][C@H1][C][C@H1][Branch2][=Branch2][=C][O][P][=Branch1][C][=O][Branch1][C][O][O][C@H1][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][=C][Branch1][C][O][N][=C][Branch1][C][N][N][=C][Ring1][Branch2][Ring1][O][C][C@@H1][Ring1][S][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][=C][Branch1][C][O][N][=C][Branch1][C][N][N][=C][Ring1][Branch2][Ring1][O][C][C@@H1][Ring1][S][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][=C][Branch1][C][O][N][=C][Branch1][C][N][N][=C][Ring1][Branch2][Ring1][O][C][C@@H1][Ring1][S][O][P][=Branch1][C][=O][Branch1][C][O][O][C@@H1][Branch2][Ring2][Branch1][C][O][C][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][=Branch1][O][Ring2][Branch2][Ring2][C][=Branch1][C][=O][NH1][C][Ring2][Branch2][O][=O] |
CHEMBL1086459 | [C][C][C][=N][C][Branch1][C][C][=C][C][Branch1][=Branch2][O][C][C][C][C][C][Ring1][Branch1][=N][C][=C][C][=C][Branch1][Ring1][O][C][N][=C][Ring1][Branch2][N][Ring2][Ring1][=Branch1][Ring2][Ring1][C] |
CHEMBL1089628 | [C][C@@H1][Branch1][#Branch2][O][P][=Branch1][C][=O][Branch1][C][O][O][C@H1][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][N][C][=Branch1][C][=O][C@H1][Branch1][S][C][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][N][C][=Branch1][C][=O][C@@H1][C][C][C][C][N][Ring1][=Branch1][C][Ring2][#Branch1][#Branch2][=O] |
CHEMBL607364 | [C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][Branch1][C][C][N][Branch1][C][OH0][C][Ring1][Branch2][Branch1][C][C][C] |
CHEMBL1087095 | [C][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][/C][=C][/C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1] |
CHEMBL1076369 | [C][O][C][=C][C][=C][Branch2][O][=Branch1][C][C@@H1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@@H1][C][S][S][C][C@H1][Branch2][Ring2][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][Ring2][Ring1][P][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch2][C][C][=C][N][=C][NH1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][C][O][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C][S][S][C][C@H1][Branch2][Ring2][Ring2][N][C][=Branch1][C][=O][C@@H1][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][=Branch1][C][=O][N][Ring1][=Branch1][C][Branch1][C][C][C][C][=Branch1][C][=O][N][Ring2][=Branch1][#C][C][=C][Ring2][#Branch1][=C] |
CHEMBL1161567 | [C][O][C][=C][C][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][Branch1][C][O][C][C][O][C][=Branch1][C][=O][C@@H1][Branch1][C][N][C][C][S][C][=C][C][=C][Ring2][Ring1][Branch1][O] |
CHEMBL1173726 | [C][C][Branch1][C][C][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][C][=C][C][=C][Branch2][Ring1][=Branch2][C][=C][C][=C][C][Branch1][#C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][=C][Ring1][=C][C][=C][Ring2][Ring1][Ring2] |
CHEMBL1170662 | [C][O][C][=C][C][=C][Branch1][=C][/C][=C][/C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][C][Branch1][Ring1][O][C][=C][Ring1][P] |
CHEMBL1187325 | [C][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=Branch1][Branch2][=C][C][=C][Ring1][=Branch1][Ring1][=N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][N][C][=C][N+1][=Branch1][Ring2][=C][Ring1][Branch1][C][C][=C][C][=C][C][=Branch1][Ring2][=N][Ring1][=Branch1][C][N+1][C][=C][N][Branch1][Ring2][C][=Ring1][Branch1][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][Ring2][Ring2][N][=O] |
CHEMBL529058 | [O][=C][Branch2][Ring1][Ring2][N][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][N][N][C][=C][C][=C][C][Branch2][Ring1][Branch2][C][N][N][=C][Branch1][C][Cl][C][Branch1][=Branch2][N][C][C][N][C][C][Ring1][=Branch1][=C][C][Ring1][=N][=O][=C][Ring2][Ring1][Branch1] |
CHEMBL1163069 | [C][C][C@H1][Branch1][C][C][C@H1][Branch1][C][N][C][=Branch1][C][=O][N][S][=Branch1][C][=O][=Branch1][C][=O][O][C][C@H1][O][C@@H1][Branch1][P][N][C][=N][C][=C][Branch1][C][N][N][=C][N][=C][Ring1][#Branch1][Ring1][#Branch2][C@H1][Branch1][C][O][C@@H1][Ring1][S][O] |
CHEMBL1169868 | [C][=C][C][C][/C][=C][/C][=C][/C][=C][/C][C][/C][=C][/C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@@H1][O][C@@H1][Branch2][Branch2][Branch1][C@H1][Branch1][C][O][C@@H1][Branch1][C][O][C][=Branch1][C][=C][C][C][C@@H1][Branch1][C][O][C@H1][C][C@@H1][Branch1][C][O][C@@H1][Branch1][C][O][C@H1][Branch2][Branch1][P][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][/C][=C][Branch1][C][\C][C][C][C@H1][Branch1][C][O][C][C@H1][Branch1][C][O][C@H1][Branch1][C][O][C][Branch1][C][C][C][Branch1][C][O][C][Branch1][C][O][C][/C][=C][/C][C][Branch1][C][O][/C][=C][/C][C][C][C][C][O][S][=Branch1][C][=O][=Branch1][C][=O][O-1][O][Ring2][Ring2][S][C][C@@H1][Branch1][C][O][C@H1][Ring2][Branch1][P][O].[Na+1] |
CHEMBL1170054 | [C][C@H1][Branch2][Ring2][Ring1][C][C][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][Ring1][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][O][C@H1][C][C][C@H1][C@H1][C@H1][Branch1][=Branch2][C][C][C@@][Ring1][=Branch1][Ring1][=Branch2][C][C@@][Branch1][C][C][C][C][C@@H1][Branch1][C][O][C][C@@H1][Ring1][Branch2][C][C@H1][Ring1][S][O] |
CHEMBL155780 | [C][C][=C][Branch1][Branch2][C][C][C][Branch1][C][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][S][=O] |
CHEMBL3347305 | [C][C][C@H1][Branch1][C][C][C@H1][Branch3][Ring1][Ring1][=N][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@@H1][Branch2][S][C][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@@H1][Branch2][=N][#Branch2][N][C][=Branch1][C][=O][C@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@@H1][Branch2][=Branch2][=Branch2][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][#C][C][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][#C][C][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][N][C][Branch1][C][C][=O][C@@H1][Branch1][C][C][C][C][C@@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][Branch1][C][N][=O] |
CHEMBL1171111 | [C][O][C][=Branch1][C][=O][C][=C][Branch1][C][C][N][C][=N][NH1][C][Branch1][C][C][=C][Ring1][=Branch1][C][Ring1][O][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1] |
CHEMBL1198407 | [C][N][Branch1][C][C][C][=C][C][=N+1][Branch1][=C][C][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][C][=C][Ring1][#C] |
CHEMBL1198965 | [C][C][O][C][=Branch1][C][=O][C][=C][N][Branch2][Branch1][N][C][=N][C][Branch1][C][N][=C][N][=C][N][Branch2][Ring2][#Branch1][C@@H1][O][C@H1][Branch2][Ring1][Branch2][C][O][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C@@H1][Branch1][C][O][C@H1][Ring2][Ring1][Branch1][O][C][Ring2][Ring1][O][=N][Ring2][Ring1][S][N][=N][Ring2][Ring2][Branch1] |
CHEMBL1200455 | [C][C][=Branch1][C][=O][N][Branch1][Branch2][C][C][Branch1][C][O][C][O][C][=C][Branch1][C][I][C][Branch1][=N][C][=Branch1][C][=O][N][C][C][Branch1][C][O][C][O][=C][Branch1][C][I][C][Branch1][=N][C][=Branch1][C][=O][N][C][C][Branch1][C][O][C][O][=C][Ring2][Ring1][Branch2][I] |
CHEMBL1185343 | [C][C][C][C][C][C][C][C][C][C][C][C][=C][C][=C][C][=C][C][=Branch2][N][=Branch1][=C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=Branch2][Branch1][=C][=C][Ring2][Ring1][=Branch1][C][=C][Ring2][Ring1][=Branch1][C][=C][C][Ring2][Ring1][Branch2][=C][Ring2][Ring1][=Branch1][C][Ring2][Ring1][Ring2][=C][Ring1][Branch1][C][=C][Ring2][Ring1][=Branch1][C][Ring2][Ring1][Ring2][=C][C][=Branch1][Branch2][=C][Ring2][Ring1][C][Ring2][Ring1][=Branch1][C][Ring2][Ring1][C][=C][Ring1][S][C][Ring1][#C][=C][Ring1][#Branch1][Ring1][#Branch2][C][Ring2][Ring2][#Branch2][C][Ring2][Ring1][=Branch2][C][=C][Ring2][Ring2][=C][C][=C][C][=Branch1][#Branch1][=C][Ring1][=Branch1][Ring2][Ring1][S][C][Branch1][Branch2][C][Ring2][Ring2][Ring1][Ring2][Ring2][=Branch1][C][Branch2][Ring1][C][C][Ring1][#Branch1][=C][Ring2][Ring2][=C][C][Ring2][Ring2][P][C][Ring1][O][Ring2][Branch1][#Branch2][C][Branch1][#Branch2][C][C][C][C][C][C][C][C][C][N+1][Branch1][C][C][Branch1][C][C][C][C][Ring2][Branch1][=C][Ring2][Branch1][O][Ring2][Ring1][Ring2][C][Ring2][=Branch1][=Branch1][Ring2][=Branch1][#Branch2][C][N+1][Ring2][=Branch1][=N][Branch1][C][C][C] |
CHEMBL1185344 | [N][C][C][O][C][C][O][C][C][N][C][C][C][=C][C][=C][C][=C][C][=Branch2][O][=N][=C][C][=C][C][=C][C][=C][C][=C][C][C][=C][C][=C][C][=Branch2][Ring2][N][=C][Ring2][Ring1][Branch1][C][=C][Ring1][=Branch1][C][=C][Ring1][#Branch2][C][Branch1][=Branch1][C][Ring1][P][=Ring1][=N][=C][Ring2][Ring1][Ring2][C][=Branch1][Branch2][=C][Ring2][Ring1][#Branch1][Ring2][Ring1][O][C][Ring1][Branch2][=C][Ring2][Ring1][=C][Ring1][O][C][Ring2][Ring2][C][C][C][C][=C][C][=Branch2][Ring1][#Branch2][=C][Ring2][Ring1][O][C][=C][Ring1][=Branch1][C][Ring1][=Branch2][C][Ring2][Ring1][=Branch2][C][Ring2][Ring1][N][C][Ring1][=Branch1][Ring2][Ring1][S][C][C][=C][Ring1][N][C][=Branch2][Ring2][O][=C][Ring2][Branch1][Branch1][C][Ring2][Ring2][=C][=C][Ring1][=Branch1][C][Ring2][Ring2][#C][C][N][Branch1][#Branch2][C][C][O][C][C][O][C][C][N][C][C][Ring2][Branch1][=Branch2][Ring1][=C][C][Ring2][Branch1][Branch2][Ring2][Ring1][=Branch1][C][Ring2][=Branch1][=Branch1][Ring2][Ring2][C][C][Ring2][=Branch1][Ring2][Ring2][=Branch1][Branch2][C][Ring2][=Branch1][O] |
CHEMBL1185354 | [C][N][C][=C][Branch2][=Branch2][#Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch2][Branch2][=Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch2][#Branch1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][=Branch1][Ring2][C][=Branch1][C][=O][N][C][C][=C][Branch2][Ring2][P][C][=Branch1][C][=O][N][C][C][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][=C][Branch1][=N][C][=Branch1][C][=O][N][C][C][C][=Branch1][C][=N][N][N][Branch1][C][C][C][=Ring1][=C][N][Branch1][C][C][C][=Ring2][Ring1][#Branch1][N][Branch1][C][C][C][=Ring2][Ring1][S][=C][Ring2][Ring2][=Branch2][=C][N][Ring2][Ring2][P][C][=C][N][Ring2][Branch1][#Branch2][C][C][=C][Ring2][=Branch1][Ring1][C][=Branch1][C][=O][N][C][C][C][=Branch1][C][=N][N] |
CHEMBL1163477 | [C][C][=Branch1][C][=O][N][C@H1][C][S][S][C][C@@H1][Branch1][=Branch1][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@@H1][Branch1][#C][C][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][Ring2][Branch1][=Branch2][=O] |
CHEMBL1171061 | [C][C@H1][O][C@@H1][Branch2][Ring2][Ring2][O][C][=C][C][=C][Branch1][C][O][C][=C][Branch1][C][O][C][=C][Ring1][Branch2][O+1][=C][Ring1][N][C][=C][C][=C][Branch1][C][O][C][Branch1][C][O][=C][Ring1][Branch2][C@@H1][Branch2][Ring1][Branch1][O][C@@H1][O][C@H1][Branch1][Ring1][C][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring1][#Branch2][O][C@@H1][Branch1][C][O][C@@H1][Ring2][Ring2][Branch2][O] |
CHEMBL1171068 | [O][=C][Branch2][Ring1][=Branch1][N][/N][=C][/C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][N][C][=C][N][=C][C][=N][Ring1][=Branch1] |
CHEMBL1171146 | [C][C@H1][C][C][C@@][Branch1][Branch1][O][C][Ring1][=Branch1][O][C@H1][C][C@H1][C@@H1][C][C][C@@H1][C][C@@H1][Branch1][C][O][C][C][C@][Ring1][#Branch1][Branch1][C][C][C@H1][Ring1][N][C][C][C@][Ring1][S][Branch1][C][C][C@H1][Ring2][Ring1][Ring2][C@@H1][Ring2][Ring1][=Branch2][C] |
CHEMBL1163408 | [C][O][C@H1][C][C][C@][Branch1][C][C][C@H1][C][C][C@H1][C][=Branch2][=Branch1][#Branch2][=C][C][C@H1][C][Branch1][C][C][Branch1][C][C][C@H1][Branch2][Branch1][C][O][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][O][C][=C][C][=C][Branch2][Ring1][=Branch2][C][O][C][=C][C][Branch1][C][O][=C][C][Branch1][C][O][=C][Ring1][Branch2][C][=Branch1][C][=O][C][=Ring1][=N][O][C][=C][Ring2][Ring1][Ring2][O][C][C][C@][Ring2][Ring2][=Branch2][Ring2][Ring2][Branch1][C][C][C@][Ring2][Ring2][#C][Branch1][C][C][C][C][C@H1][Ring2][Branch1][Branch1][C][Ring2][Branch1][=Branch2][Branch1][C][C][C] |
CHEMBL1163452 | [C][C][Branch1][C][C][Branch1][C][C][O][C][C@H1][O][C@@H1][Branch2][Ring2][=Branch1][O][C@@H1][O][C][=Branch1][C][=O][C][=C][C][=Branch1][C][=O][C][=C][Branch1][#C][C][O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C@H1][Ring1][=C][Ring2][Ring1][Ring1][C@H1][Branch1][=C][O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C@@H1][Branch1][=C][O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C@@H1][Ring2][Ring2][Branch2][O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C] |
CHEMBL1223923 | [C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][Branch2][Ring2][N][C][C@H1][Branch2][Ring2][C][N][C][=Branch1][C][=O][C@@H1][O][C][O][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring2][Ring2][C] |
CHEMBL1223924 | [O][=C][Branch1][C][O][C@H1][Branch2][Ring1][#Branch2][C][C][=C][C][=C][Branch1][#C][O][C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][F][C][=C][Ring1][S][N][C][=Branch1][C][=O][C@@H1][O][C][O][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL1229162 | [C][C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][/C][=Branch2][Ring1][Branch2][=C][\C][=C][C][=N+1][Branch1][=N][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][=C][Ring1][=C][C][Ring2][Ring1][Branch1][=O] |
CHEMBL1215827 | [C][C][C@H1][O][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][=Branch1][C][=O][C@H1][Branch1][C][C][C@@H1][Branch2][Ring1][Branch1][O][C@@H1][O][C@H1][Branch1][C][C][C][C@H1][Branch1][=Branch1][N][Branch1][C][C][C][C@H1][Ring1][#Branch2][O][C@][Branch1][C][C][Branch2][Ring1][#Branch2][O][C][C][Branch1][C][O][C][N][C][C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][C@@H1][Branch1][C][O][C@][Ring2][Branch1][Branch1][Branch1][C][C][O] |
CHEMBL1163222 | [C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=C][Branch2][Ring1][S][N][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#C][S][=Branch1][C][=O][=Branch1][C][=O][/N][=C][/N][Branch1][C][C][C][C][=C][Ring1][=C][C][C][N][Branch2][Ring1][=C][C][C][C][O][C][=C][C][Branch1][C][F][=C][C][Branch1][=N][C][Branch1][Ring1][O][C][C][C][O][C][C][Ring1][Branch2][=C][Ring1][#C][C][Ring2][Ring2][#Branch2].[Cl] |
CHEMBL1183295 | [C][N+1][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][N][=C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][O][=C][Ring1][#C] |
CHEMBL1181959 | [C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring2][S][O][C][=N][C][Branch1][P][O][C][=C][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=N][N][=C][Ring1][=Branch2][=C][Branch1][C][F][C][Branch1][=C][N][Branch1][=Branch1][C][Branch1][C][C][C][C][Branch1][C][C][C][=C][Ring2][Ring1][Branch2][F][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring2][Ring2][Ring1] |
CHEMBL1184258 | [C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][N][O][C][=Branch1][C][=O][C][C][C][O][C][Branch2][Ring1][Ring1][C][O][C][=Branch1][C][=O][C][C][C][C][C][N+1][C][=C][S][C][=Ring1][Branch1][C][Ring2][Ring1][Ring1] |
CHEMBL1169669 | [C][N][Branch3][Ring2][Ring1][Ring2][/N][=C][/C][=C][C][=C][Branch3][Ring2][C][Ring2][O][P][Branch2][Branch2][C][O][C][=C][C][=C][Branch2][#Branch1][Branch1][/C][=N][/N][Branch2][Ring2][Ring2][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][=C][Ring2][Ring1][Ring1][P][Branch1][C][O][=Branch1][C][=S][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][=C][Ring2][Ring1][Ring1][C][=C][Ring2][Branch1][Ring1][=N][P][Branch2][Branch2][Ring1][O][C][=C][C][=C][Branch2][#Branch1][=Branch1][/C][=N][/N][Branch1][C][C][P][=Branch1][C][=S][Branch2][Ring2][Branch1][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][=C][Ring2][Ring1][Ring1][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][=C][Ring2][Ring1][Ring1][C][=C][Ring2][Branch1][Ring2][Branch2][Branch2][Ring1][O][C][=C][C][=C][Branch2][#Branch1][=Branch1][/C][=N][/N][Branch1][C][C][P][=Branch1][C][=S][Branch2][Ring2][Branch1][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][=C][Ring2][Ring1][Ring1][O][C][=C][C][=C][C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][P][=Branch1][C][=O][Branch1][C][O-1][O][=C][Ring2][Ring1][Ring1][C][=C][Ring2][Branch1][Ring2][=N][P][Branch2][Branch2][Ring1][O][C][=C][C][=C][Branch2][#Branch1][=Branch1][/C][=N][/N][Branch1][C][C][P][=Branch1][C][=S][Branch2][Ring2][Branch1][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][=C][Ring2][Ring1][Ring1][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][=C][Ring2][Ring1][Ring1][C][=C][Ring2][Branch1][Ring2][Branch2][Branch2][Ring1][O][C][=C][C][=C][Branch2][#Branch1][=Branch1][/C][=N][/N][Branch1][C][C][P][=Branch1][C][=S][Branch2][Ring2][Branch1][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][=C][Ring2][Ring1][Ring1][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][=C][Ring2][Ring1][Ring1][C][=C][Ring2][Branch1][Ring2][=N][Ring3][Ring1][C][=C][C][=C][Ring3][Ring1][Ring1][Branch1][P][=Branch1][C][=S][Branch2][Ring2][Branch1][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][=C][Ring2][Ring1][Ring1][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][P][=Branch1][C][=O][Branch1][C][O-1][O][C][=C][Ring2][Ring1][Ring1].[Na+1].[Na+1].[Na+1].[Na+1].[Na+1].[Na+1].[Na+1].[Na+1].[Na+1].[Na+1].[Na+1].[Na+1].[Na+1].[Na+1].[Na+1].[Na+1].[Na+1].[Na+1].[Na+1].[Na+1].[Na+1].[Na+1].[Na+1].[Na+1] |
CHEMBL1182707 | [C][O][C][=C][C][=C][Branch1][#Branch1][C][=C][Ring1][=Branch1][O][C][C@H1][Branch2][Ring1][Branch1][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][N][N@@+1][Branch1][C][C][Branch2][=Branch1][Ring2][C][C][C][O][C][=Branch1][C][=O][C][C][C][C][C][C][=Branch1][C][=O][O][C][C][C][N@+1][Branch1][C][C][C][C][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][#Branch2][C@H1][Ring1][#C][C][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][N][C][C][Ring2][=Branch1][Ring2] |
CHEMBL199468 | [N][#C][C][=C][C][=C][Branch2][Branch1][Ring1][C][N][C][=N][N][=C][Ring1][Branch1][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][#Branch2][C][=C][C][=C][Branch1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=N][C][=C][Ring2][Ring2][#Branch1] |
CHEMBL1199236 | [N][#C][C@H1][C][S][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][N][Branch1][C][N][C][C][C][N][Branch2][Ring1][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Cl][C][=N][Ring1][#Branch1][C][C][Ring1][P] |
CHEMBL1162308 | [C][C][=C][N][Branch3][Ring2][Branch1][P][C][C][Branch1][C][C][Branch2][=Branch2][=Branch2][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch1][S][N][C][=C][Branch1][C][C][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][C][C@@H1][Ring1][=C][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][C][=Branch1][C][=O][NH1][C][Branch1][C][N][=N][C][=Ring1][Branch2][Ring1][O][C@H1][Branch1][C][O][C@@H1][Ring1][P][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][C][=Branch1][C][=O][NH1][C][Branch1][C][N][=N][C][=Ring1][Branch2][Ring1][O][C@H1][Branch1][C][O][C@@H1][Ring1][P][O][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C@@H1][C@@H1][Branch3][Ring1][O][Ring2][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C@@H1][C@@H1][Branch3][Ring1][Branch2][#Branch1][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C@H1][C][C@H1][Branch1][S][N][C][=C][Branch1][C][C][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][O][C@@H1][Ring1][=C][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C@@H1][C@@H1][Branch3][Ring1][Ring1][Branch2][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C@H1][C][C@H1][Branch1][S][N][C][=C][Branch1][C][C][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][O][C@@H1][Ring1][=C][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C@@H1][C@@H1][Branch2][=C][#Branch2][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C@@H1][C@@H1][Branch2][O][=C][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C@H1][C][C@H1][Branch1][S][N][C][=C][Branch1][C][C][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][O][C@@H1][Ring1][=C][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C@H1][C][C@H1][Branch1][S][N][C][=C][Branch1][C][C][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][O][C@@H1][Ring1][=C][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C@@H1][C@@H1][Branch2][Ring2][=C][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C@@H1][C@@H1][Branch1][Ring1][C][O][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][C][=Branch1][C][=O][NH1][C][Branch1][C][N][=N][C][=Ring1][Branch2][Ring1][O][C@@H1][Ring2][Ring1][C][O][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][C][=Branch1][C][=O][NH1][C][Branch1][C][N][=N][C][=Ring1][Branch2][Ring1][O][C@@H1][Ring2][Ring2][=Branch2][O][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][C][=Branch1][C][=O][NH1][C][Branch1][C][N][=N][C][=Ring1][Branch2][Ring1][O][C@@H1][Ring2][Branch2][Branch2][O][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][C][=Branch1][C][=O][NH1][C][Branch1][C][N][=N][C][=Ring1][Branch2][Ring1][O][C@@H1][Ring2][=Branch2][#C][O][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][C][=Branch1][C][=O][NH1][C][Branch1][C][N][=N][C][=Ring1][Branch2][Ring1][O][C@@H1][Ring2][N][#Branch2][O][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][C][=Branch1][C][=O][NH1][C][Branch1][C][N][=N][C][=Ring1][Branch2][Ring1][O][C@@H1][Ring2][#C][Branch1][O][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][C][=Branch1][C][=O][NH1][C][Branch1][C][N][=N][C][=Ring1][Branch2][Ring1][O][C@@H1][Ring2][S][N][O][C][=Branch1][C][=O][NH1][C][Ring3][Ring1][Branch1][P][=O] |
CHEMBL1160741 | [C][N][Branch1][C][C][C][=N][C][=N][C][=C][Ring1][=Branch1][N][=C][N][Ring1][Branch1][C][C][C][C][C][O][C][=Branch1][C][=O][C][C][N] |
CHEMBL14582 | [C][N+1][Branch1][C][C][Branch2][Branch1][P][C][C][C][C][C][C][N+1][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][F][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][Branch1][C][F][F].[Br-1].[Br-1] |
CHEMBL1162209 | [C][O][C][=C][Branch1][C][O][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][#Branch2][O][S][=Branch1][C][=O][=Branch1][C][=O][O] |
CHEMBL1162315 | [C][C][C][C][C][C][C][C][C][/C][=C][/C][C][C][C][C][C][C][C][=Branch1][C][=O][O][C][C@@H1][Branch1][C][O][C][O][P][=Branch1][C][=O][Branch1][C][O][O] |
CHEMBL1202061 | [C][C][O][C][=Branch1][C][=O][C][=Branch1][C][=O][O][C][=C][C][=C][Branch2][Ring1][#C][C][=C][Branch1][Branch2][C][=Branch1][C][=O][O][C][C][O][C][=C][C][Branch1][C][O][=C][C][Branch1][C][O][=C][Ring1][Branch2][C][Ring1][P][=O][C][=C][Ring2][Ring1][Branch2].[O][=C][Branch1][C][O][C][=Branch1][C][=O][O] |
CHEMBL1171643 | [C][C][Branch1][C][C][=C][C][C][/C][Branch1][C][C][=C][/C][C][C@@][Branch1][C][C][C][=C][C][=C][Branch2][Ring1][C][C][=C][Branch1][C][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][#Branch2][O][O][Ring1][S] |
CHEMBL1185125 | [N][C@@H1][Branch1][Ring1][C][S][C][C][=Branch1][C][=O][N][C][C@H1][O][C@@H1][O][C@@H1][C@@H1][Branch1][=N][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][N][C][S][O][C@H1][Branch2][N][=Branch2][O][C@@H1][C@@H1][Branch1][=N][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][N][C][S][O][C@H1][Branch2][#Branch2][#Branch2][O][C@@H1][C@@H1][Branch1][=N][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][N][C][S][O][C@H1][Branch2][Branch2][O][O][C@@H1][C@@H1][Branch1][=N][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][N][C][S][O][C@H1][Branch2][=Branch1][N][O][C@@H1][C@@H1][Branch1][=N][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][N][C][S][O][C@H1][Branch2][Ring2][=N][O][C@@H1][C@@H1][Branch1][=N][C][N][C][Branch1][C][O][C@@H1][Branch1][C][N][C][S][O][C@H1][Branch1][#C][O][C@H1][Ring2][#Branch1][Ring1][C@H1][Branch1][C][O][C@H1][Ring2][#Branch1][Ring2][O][C@H1][Branch1][C][O][C@H1][Ring2][Ring1][Branch1][O][C@H1][Branch1][C][O][C@H1][Ring2][Ring2][=Branch1][O][C@H1][Branch1][C][O][C@H1][Ring2][Branch1][#Branch1][O][C@H1][Branch1][C][O][C@H1][Ring2][=Branch1][Branch2][O][C@H1][Branch1][C][O][C@H1][Ring2][#Branch1][=Branch2][O][C@H1][Branch1][C][O][C@H1][Ring2][Branch2][#Branch2][O] |
CHEMBL1185903 | [C][C][=C][N][Branch2][N][=Branch2][C@H1][C][C@H1][Branch2][=Branch2][#Branch1][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][=C][Branch1][C][O][N][=C][Branch1][C][N][N][=C][Ring1][Branch2][Ring1][O][C][C@@H1][Ring1][S][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][=C][Branch1][C][O][N][=C][Branch1][C][N][N][=C][Ring1][Branch2][Ring1][O][C][C@@H1][Ring1][S][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][=C][Branch1][C][O][N][=C][Branch1][C][N][N][=C][Ring1][Branch2][Ring1][O][C][C@@H1][Ring1][S][O][C@@H1][Branch2][Ring2][Branch1][C][O][C][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][=Branch1][O][Ring2][#Branch1][P][C][=Branch1][C][=O][NH1][C][Ring2][Branch2][Branch2][=O] |
CHEMBL1185910 | [C][C][=C][N][Branch2][S][C][C@H1][C][C@H1][Branch2][=N][P][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][C][=Branch1][C][=O][NH1][C][Branch1][C][N][=N][C][=Ring1][Branch2][Ring1][O][C][C@@H1][Ring1][S][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][C][=Branch1][C][=O][NH1][C][Branch1][C][N][=N][C][=Ring1][Branch2][Ring1][O][C][C@@H1][Ring1][S][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][C][=Branch1][C][=O][NH1][C][Branch1][C][N][=N][C][=Ring1][Branch2][Ring1][O][C][C@@H1][Ring1][S][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch1][P][N][C][=N][C][=C][Branch1][C][N][N][=C][N][=C][Ring1][#Branch1][Ring1][#Branch2][C][C@@H1][Ring1][#C][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch2][Ring1][Ring2][N][C][=N][C][C][=Branch1][C][=O][NH1][C][Branch1][C][N][=N][C][=Ring1][Branch2][Ring1][O][C][C@@H1][Ring1][S][O][C@@H1][Branch2][Ring1][Ring2][C][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring2][#Branch2][C][C][=Branch1][C][=O][NH1][C][Ring2][#Branch2][=Branch2][=O] |
CHEMBL1184808 | [C][N+1][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][C][Ring1][Branch2][=C][C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][=Branch2][Ring2][Ring1][Ring1] |
CHEMBL1185294 | [N][C@@H1][Branch1][#C][C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2][C][=Branch1][C][=O][N][C@@H1][Branch1][#C][C][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][C][C][C][C][C][C][C][C][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl] |
CHEMBL1201356 | [C][C][C@@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@@H1][C][=C][C][=C][C][=C][C][NH1][C][=C][Branch1][=Branch1][C][Ring1][=Branch2][=Ring1][Branch1][C][C@H1][Ring1][N][N][Branch1][C][C][C][Ring1][P] |
CHEMBL1161117 | [C][C][C@H1][Branch1][C][C][C@@H1][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@H1][Branch2][=Branch2][Ring1][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C][N][C][C][C][=Branch1][C][=O][N][C][C][C][C][C@@H1][Branch2][Branch1][#Branch2][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][Branch1][C][N][=O][N][C][Ring2][=Branch2][S][=O] |
CHEMBL1161119 | [C][C][Branch1][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][N][Branch2][Ring1][Branch2][C][C][=C][C][=C][C][Branch1][=N][C][N][C][=Branch1][C][=O][C][C][C][Ring1][=Branch1][=O][=C][Ring1][=C][C][C][Ring2][Ring1][Branch1].[O][=C][Branch1][C][O][C][C][C][=Branch1][C][=O][O] |
CHEMBL9527 | [Cl].[O][=C][Branch1][Branch2][C][C][C][C][N][Ring1][Branch1][N][C][C][C][C][Ring1][Branch1][P][=Branch1][C][=O][Branch2][Ring1][Ring2][O][C][=C][C][=C][Branch1][=Branch2][N][N][C][C][C][C][Ring1][Branch1][C][=C][Ring1][N][O][C][=C][C][=C][Branch1][=Branch2][N][N][C][C][C][C][Ring1][Branch1][C][=C][Ring1][N] |
CHEMBL1185408 | [N][=C][Branch1][C][N][C][=C][C][=C][Branch2][Ring2][O][C][=N][O][C][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][P][N][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][=Branch1][C][=O][O][C][Ring2][Ring1][#Branch2][C][=C][Ring2][Ring1][S] |
CHEMBL1187868 | [O][C][=C][C][=C][Branch2][Ring1][=Branch2][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][=C][Ring1][#Branch1][C][=C][C][=N][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][=Branch1][O] |
CHEMBL1160584 | [C][C][=C][C][Branch2][=Branch2][C][C][=C][C][Branch1][C][C][=C][Branch2][#Branch1][O][N][C][=N][C][Branch2][Ring2][=Branch1][N][C][=C][C][=C][C][Branch2][Ring1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][C][C][Branch1][C][N][=O][=C][Ring2][Ring1][Ring2][=N][C][Branch2][Ring2][=Branch1][N][C][=C][C][=C][C][Branch2][Ring1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][C][C][Branch1][C][N][=O][=C][Ring2][Ring1][Ring2][=N][Ring2][Ring2][S][C][=C][Ring2][Branch1][Branch2][S][=Branch1][C][=O][=Branch1][C][=O][O][=C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][O][C][=C][Ring2][=Branch1][=Branch1][N][C][=N][C][Branch2][Ring2][=Branch1][N][C][=C][C][=C][C][Branch2][Ring1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][C][C][Branch1][C][N][=O][=C][Ring2][Ring1][Ring2][=N][C][Branch2][Ring2][=Branch1][N][C][=C][C][=C][C][Branch2][Ring1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][C][C][Branch1][C][N][=O][=C][Ring2][Ring1][Ring2][=N][Ring2][Ring2][S] |
CHEMBL1179704 | [C][C][O][C][=Branch1][C][=O][/C][=C][/C@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][=N][C][=C][N][Ring1][Branch1][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL1184569 | [C][C][=C][C][Branch1][=Branch1][C][Branch1][C][C][C][=N+1][Branch1][Branch2][C][C][=C][NH1][N][=Ring1][Branch1][C][Branch1][=Branch1][C][Branch1][C][C][C][=C][Ring1][P] |
CHEMBL1185320 | [C][C][=Branch1][C][=O][O][C@H1][C][=Branch1][C][=O][C@][Branch1][C][C][C@@H1][Branch1][C][O][C][C@H1][O][C][C@@][Ring1][Ring2][Branch1][#Branch1][O][C][Branch1][C][C][=O][C@H1][Ring1][=C][C@H1][Branch1][=C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C@][Branch1][C][O][C][C][Branch2][#Branch1][=Branch2][O][C][=Branch1][C][=O][C@H1][Branch2][Branch1][Branch2][O][C][=Branch1][C][=O][N][Branch1][C][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][N][C][Branch1][C][C][C][C][Branch1][=C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][=C][Ring2][#Branch1][#Branch1][C][Ring2][Branch1][=N][Branch1][C][C][C] |
CHEMBL1185327 | [C][N][C][Branch1][C][N][=C][Branch1][Branch1][C][C][C][N][C][=N+1][Ring1][#Branch2][C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@@H1][Branch2][Ring1][P][N][C][=Branch1][C][=O][/C][=Branch1][#C][=N][\O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][O][C][=N][S][C][Branch1][C][N][=N][Ring1][=Branch1][C@H1][Ring2][Ring1][#Branch1][S][C][Ring2][Ring1][=C] |
CHEMBL165039 | [C][C][Branch1][C][C][C@H1][Branch2][Branch1][Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][C][N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][C][C][C][C][Ring2][Ring1][Ring1][C][=Branch1][C][=O][N][C@H1][Branch1][N][C][=Branch1][C][=O][N][C][C][Branch1][C][N][=O][C][Branch1][C][C][C] |
CHEMBL1161854 | [C][C][Branch1][C][C][Branch2][Branch1][=Branch2][C][O][P][=Branch1][C][=O][Branch1][C][O][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch1][P][N][C][=N][C][=C][Branch1][C][N][N][=C][N][=C][Ring1][#Branch1][Ring1][#Branch2][C@H1][Branch1][C][O][C@@H1][Ring1][S][O][P][=Branch1][C][=O][Branch1][C][O][O][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C][=Branch1][C][=O][N][C][C][S][C][C][=Branch1][C][=O][N][C][C@H1][O][C@H1][Branch2][Ring1][Ring2][O][C@@H1][C@@H1][Branch1][C][N][C][C@@H1][Branch1][C][N][C@H1][Branch1][C][O][C@H1][Ring1][=Branch2][O][C@H1][Branch1][C][N][C@@H1][Branch1][C][O][C@@H1][Ring2][Ring1][Ring1][O] |
CHEMBL1161856 | [C][C][Branch1][C][C][Branch2][Branch1][=Branch2][C][O][P][=Branch1][C][=O][Branch1][C][O][O][P][=Branch1][C][=O][Branch1][C][O][O][C][C@H1][O][C@@H1][Branch1][P][N][C][=N][C][=C][Branch1][C][N][N][=C][N][=C][Ring1][#Branch1][Ring1][#Branch2][C@H1][Branch1][C][O][C@@H1][Ring1][S][O][P][=Branch1][C][=O][Branch1][C][O][O][C@@H1][Branch1][C][O][C][=Branch1][C][=O][N][C][C][C][=Branch1][C][=O][N][C][C][S][C][C][C][C][=Branch1][C][=O][N][C][C@H1][O][C@H1][Branch2][Ring1][Ring2][O][C@@H1][C@@H1][Branch1][C][N][C][C@@H1][Branch1][C][N][C@H1][Branch1][C][O][C@H1][Ring1][=Branch2][O][C@H1][Branch1][C][N][C@@H1][Branch1][C][O][C@@H1][Ring2][Ring1][Ring1][O] |
CHEMBL1163470 | [C][C][Branch1][C][C][C@H1][Branch2][Branch2][#Branch2][N][C][=Branch1][C][=O][C@@H1][C][S][S][C][C@H1][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][Ring2][Branch1][N][C][=Branch1][C][=O][O] |
CHEMBL1161944 | [C][C][C][C][C][C][C][O][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2] |
CHEMBL1163390 | [C][O][C][=C][C][Branch2][Branch2][Branch1][/C][=C][/C][Branch1][C][O][/C][=C][Branch1][C][O][/C][=C][/C][=C][C][=C][Branch2][=Branch1][Branch2][O][C][=Branch1][C][=O][C][C][=Branch1][C][=O][O][C@@H1][C][C][C@][Branch1][C][C][C@H1][C][C][C@H1][C@@][Branch1][C][C][Branch2][Ring1][Branch2][C][C][C@H1][C][Branch1][C][C][Branch1][C][C][C@H1][Branch1][Ring1][O][C][C][C][C@][Ring1][#C][Ring1][#Branch2][C][C][C][Ring2][Ring1][Branch1][=C][C][C@H1][Ring2][Ring1][#Branch2][C][Ring2][Ring1][=C][Branch1][C][C][C][C][Branch1][Ring1][O][C][=C][Ring2][Ring2][#C][=C][C][=C][Ring2][Branch1][=C][O] |
CHEMBL1171366 | [C][O][C@@H1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@][Branch2][Ring1][Ring1][C][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=N][O][Ring2][Ring1][=Branch1] |
CHEMBL1200735 | [C][O][C][=C][Branch1][=C][N][C][C@@H1][C][C][C][N][C@@H1][Ring1][=Branch1][C][Ring1][=Branch2][C][Branch1][C][F][=C][C][C][=Branch1][C][=O][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring2][Ring1][O][=Ring1][=N].[Cl] |
CHEMBL1171133 | [C][O][C][=C][C][=C][C][Branch2][Branch1][=Branch2][O][C@@H1][C][C@H1][C][=Branch1][C][=O][N][C@][Branch2][Ring1][C][C][=Branch1][C][=O][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][Ring1][Ring1][C][C@H1][Ring1][N][/C][=C][\C][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C@@H1][Ring2][Ring1][O][C][Ring2][Ring1][=C][=N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][C][Ring2][Ring2][O][=C][Ring2][Ring2][#C][C] |
CHEMBL1185285 | [N][C][C][O][C][C][O][C][C][N][C][C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][Branch2][#Branch1][O][C][Ring2][Ring1][Branch2][=C][Ring1][=Branch1][C][=C][C][=C][C][=Branch2][Branch1][P][=C][Ring2][Ring1][=N][C][=Branch1][Branch2][=C][Ring2][Ring1][=C][Ring2][Ring1][#Branch2][C][=C][Ring2][Ring1][O][C][=C][Ring2][Ring1][O][C][=Branch1][Branch2][=C][Ring2][Ring1][N][Ring2][Ring1][Branch2][C][=C][Ring2][Ring1][=Branch2][C][=Branch1][Branch2][=C][Ring2][Ring1][=Branch2][Ring2][Ring1][C][C][Ring1][P][=C][Ring1][=Branch1][C][Ring1][O][=C][Ring2][Ring1][Ring1][Ring1][=C][C][Ring2][Ring1][=Branch1][Ring2][Ring2][S][C][Ring2][Branch1][Ring1][C][Ring2][Ring2][P][C][Ring2][Ring2][#C][C][=C][Ring2][Ring1][S][C][=Branch2][Ring2][O][=C][Ring2][Ring2][#Branch2][C][Branch2][Ring1][Branch2][C][N][Branch1][#Branch2][C][C][O][C][C][O][C][C][N][C][C][Ring2][Ring1][C][Ring2][Branch1][S][Ring1][=C][C][Ring2][Branch1][#Branch2][C][Ring2][Branch1][P][Ring2][Branch1][=C][C][Ring2][Branch1][Ring2][C][Ring2][Branch1][O][Ring2][Branch1][Branch2] |
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