chembl_id stringlengths 7 13 | selfies stringlengths 3 6.7k |
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CHEMBL4228905 | [C][C][C][=C][N][=C][Branch2][Ring2][#Branch2][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][Branch2][Ring1][#Branch1][C][C][C][O][C][=C][C][=C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][=C][Ring1][#Branch2][C][Ring2][Ring1][Ring2][N][=C][Ring2][Ring1][=N] |
CHEMBL4228906 | [O][=C][Branch1][#Branch2][N][C][C][C][C][C][C][Ring1][=Branch1][C][=C][C][=C][Branch2][Ring2][N][C][N][N][=C][Branch2][Ring1][Branch2][N][C][=C][C][=C][Branch1][=N][C][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring1][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][=Branch2][=O][C][=C][Ring2][Ring1][P] |
CHEMBL4228907 | [C][C][Branch2][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][Ring1][C][#N][C][Branch1][C][Cl][=C][Ring1][=Branch2][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][N][Ring1][=N][C][C][C][C][Ring1][Ring1] |
CHEMBL4228908 | [C][C][=C][C][=C][Branch2][Ring1][=Branch1][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][C][=C][N][=C][Ring1][=N][Ring1][=Branch1][S][Ring2][Ring1][C] |
CHEMBL4228909 | [C][C][C@H1][Branch1][C][C][C@H1][Branch2][=N][=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][Branch1][=Branch2][C][C][=C][N][=C][NH1][Ring1][Branch1][N][C][=Branch1][C][=O][C@@H1][C][S][S][C][C@H1][Branch2][#Branch1][=C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][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][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][N][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][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][Ring2][#Branch1][N][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][C][=Branch1][C][=O][O] |
CHEMBL4228999 | [O][=C][Branch1][#Branch2][N][O][C][Branch1][Ring1][C][O][C][O][C][=C][C][C][=C][O][C][=Ring1][Branch1][C][Branch1][C][F][=C][Ring1][#Branch2][N][C][=C][C][=C][Branch1][C][I][C][=C][Ring1][#Branch1][F] |
CHEMBL4229000 | [C][C][N][=C][S][C][=Ring1][Branch1][C][=C][C][=C][Branch2][#Branch1][=C][C][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Branch1][C][O][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][Branch2][Branch1][=C][N][C][=Branch1][C][=O][C][O][C][C][C][O][C][C][C][O][C][=C][C][=C][Branch2][Ring2][Ring1][N][C][=N][C][=C][Branch1][C][Br][C][Branch2][Ring1][Ring1][N][C][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][=N][Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][#Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring2][Branch1][=C] |
CHEMBL4229001 | [C][C][O][C][=C][C][=Branch1][P][=C][Branch1][Ring2][O][C][C][C][=C][C][=C][C][=C][Ring1][=N][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][=C][Ring1][#Branch2][O][C][C][Ring2][Ring1][N] |
CHEMBL4229002 | [C][O][C][=C][C][=C][Branch2][Branch1][P][C][N][C][=Branch1][C][=O][C][=Branch2][Ring1][#Branch2][=C][Branch1][N][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=C][C][Branch1][P][/C][=C][/C][=C][C][=C][Branch1][C][C][C][Branch1][C][C][=C][Ring1][Branch2][=C][C][=C][Ring1][S][Ring2][Ring2][Ring1][C][=C][Ring2][Ring2][#Branch2] |
CHEMBL4229003 | [C][C][Branch1][C][C][C][C][N][C][C][C][Branch2][Ring2][Ring2][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][C][C][Ring2][Ring1][O] |
CHEMBL4229004 | [C][C][O][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][C@][Branch1][C][C][C][C][C@][Branch1][C][C][C][=Branch2][=Branch1][C][=C][C][=Branch1][C][=O][C@@H1][C@@][Branch1][C][C][C][C][C@H1][Branch2][Ring1][=N][O][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][S][Ring1][#Branch2][C][Branch1][C][C][Branch1][C][C][C@@H1][Ring2][Ring1][O][C][C][C@][Ring2][Ring1][#C][Ring2][Ring2][Branch1][C][C@@H1][Ring2][Ring2][O][C][Ring2][Ring2][S] |
CHEMBL4229086 | [C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][=N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F][=C][C][=C][Ring1][=C][O] |
CHEMBL4229087 | [C][C][=C][C][=C][C][Branch2][=Branch1][N][C][=N][N][=C][Branch2][Branch1][P][C][O][C][=Branch1][C][=O][C@][C][C][C@@H1][Branch1][C][C][C@H1][Branch1][C][C][C@H1][Ring1][Branch2][C][=C][C][C@@H1][C@@][Branch1][C][C][C][C][C@H1][Branch1][C][O][C][Branch1][C][C][Branch1][C][C][C@@H1][Ring1][#Branch2][C][C][C@@][Ring1][=C][Branch1][C][C][C@][Ring2][Ring1][Ring1][Branch1][C][C][C][C][Ring2][Ring1][=C][O][Ring2][Ring2][#Branch1][=C][Ring2][Ring2][=N] |
CHEMBL4229088 | [C][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][C][=C][C][Branch2][Ring1][Branch1][C][=C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][N][Ring1][=Branch1][=C][Ring2][Ring1][C] |
CHEMBL4229089 | [C][O][C][=C][C][=C][N][=C][C][=C][Branch2][Ring1][P][C][C][C@H1][O][C][C@H1][Branch2][Ring1][Ring1][N][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][O][Ring1][#Branch1][C][O][Ring2][Ring1][C][C][Ring2][Ring1][#Branch2][=C][Ring2][Ring1][=C] |
CHEMBL4229090 | [C][O][C][=C][C][=C][Branch1][P][/N][=C][/C][=C][C][=C][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][C][=C][Ring2][Ring1][C] |
CHEMBL4229175 | [C][O][C][=C][Branch2][Ring1][O][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2][C][=C][O][C][=C][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][Branch2][C][=Branch1][C][=O][C][Ring1][=N][=C][Ring2][Ring1][#C][O] |
CHEMBL4229176 | [C][C][=C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][=C][Branch1][C][O][C][Ring1][#Branch2][=N][Ring1][=C] |
CHEMBL4229177 | [C][C][=N][C][=C][Branch1][Ring2][NH1][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][C][Cl][=C][Branch1][S][N][C][=C][C][Branch1][C][F][=C][C][Branch1][C][F][=C][Ring1][Branch2][C][Ring2][Ring1][C][=O] |
CHEMBL4229178 | [C][C][C][C][C][C][C][C][C][C][N][C][C][C][Branch1][N][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1][C][Ring1][N] |
CHEMBL4229179 | [C][=C][S][C][Branch2][Ring1][=Branch2][C][=N][N][=C][Branch1][S][C][N][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][O][Ring1][S][=C][Ring2][Ring1][Branch1] |
CHEMBL4229261 | [O][=C][/C][=Branch1][=N][=C][\C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][N][Ring1][P][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL4229262 | [C][C][O][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C][C@][Branch1][C][C][C][C][C@][Branch1][C][C][C][=Branch2][=Branch1][C][=C][C][=Branch1][C][=O][C@@H1][C@@][Branch1][C][C][C][C][C@H1][Branch2][Ring1][=N][O][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][C][=N][C][=C][Branch1][C][C][C][=C][C][=C][Ring1][#Branch1][S][Ring1][#Branch2][C][Branch1][C][C][Branch1][C][C][C@@H1][Ring2][Ring1][O][C][C][C@][Ring2][Ring1][#C][Ring2][Ring2][Branch1][C][C@@H1][Ring2][Ring2][O][C][Ring2][Ring2][S] |
CHEMBL4229263 | [C][N][C][=C][Branch2][Ring2][#C][C][=C][C][=C][Branch2][Ring2][Ring1][C][N][C][=C][Branch1][#C][C][=Branch1][C][=O][N][C@H1][C][C][C][C][C@@H1][Ring1][=Branch1][O][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Ring2][Ring1][Ring2][C][=C][Ring2][Ring1][O][C][=N][Ring2][Ring1][S] |
CHEMBL4229264 | [C][C][O][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][C][O][C][=C][C][=N][N][Ring1][Branch1][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C][=N][Ring1][=Branch2] |
CHEMBL4229265 | [C][O][C][=C][C][=C][Branch2][Ring2][O][C][=C][C][=C][N][=C][N][=C][Branch2][Ring1][Branch2][N][C@H1][C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][N][C][Ring2][Ring1][Ring1][=C][Ring2][Ring1][#Branch1][C][=N][Ring2][Ring1][=N] |
CHEMBL4229266 | [C][=C][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch2][Ring2][O][N][C][=Branch1][C][=O][N][C][=C][C][=N][C][Branch2][Ring1][=Branch2][N][C][=C][C][=C][Branch1][N][C][=Branch1][C][=O][N][Branch1][Ring1][C][C][C][C][C][=C][Ring1][=N][O][C][=N][Ring2][Ring1][=Branch1][=C][Ring2][Ring1][S] |
CHEMBL4289351 | [O][=C][Branch2][Ring1][#Branch2][C][C][N][C][C][C][Branch1][=C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Ring1][=Branch2][C][C][Ring1][#C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][=Branch1][C][=O][N][Ring1][Branch2][C][C][C][Ring1][N] |
CHEMBL4289352 | [C][O][C][=C][C][=C][C][Branch2][#Branch1][=Branch1][C][O][C][=C][Branch2][Branch1][P][C][=C][C][=C][Branch2][Branch1][Branch1][O][C][C][O][C][C][N][C][=C][Branch2][Ring2][Ring2][C][C][C][C][O][C][=C][C][=C][Branch2][Ring1][Ring1][/C][=C][/C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][O][C][=C][Ring2][Ring1][C][N][=N][Ring2][Ring1][N][C][=C][Ring2][Ring2][Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Branch1][C][=O][=C][Ring2][Branch1][O] |
CHEMBL4289353 | [C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][Branch2][Ring2][N][O][C][=C][C][=N][C][Branch2][Ring1][#C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#C][N][C][C@H1][Branch1][C][C][N][C@H1][Branch1][C][C][C][Ring1][Branch2][C][=C][Ring1][=C][C][=C][Ring2][Ring1][Branch2][=C][C][=C][Ring2][Ring2][Ring1][Ring2][Ring1][#C] |
CHEMBL4289354 | [C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][N][=O][C][=C][Ring1][=Branch2][C][C][C][N][Branch2][Ring1][=Branch2][C][=N][N][=C][Branch1][=Branch2][C][=C][C][=N][N][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][S][Ring1][=Branch1][C][C][Ring2][Ring1][=Branch1] |
CHEMBL4289355 | [C][N][N][=C][Branch2][Ring2][#Branch1][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][C][=C][Branch1][C][N][N][=C][N][=C][Ring1][#Branch1][Ring2][Ring1][S] |
CHEMBL4289356 | [C][O][C][=C][Branch1][C][O][C][=C][C][=Branch1][Branch1][=C][Ring1][#Branch1][O][C@@H1][O][C@H1][Branch2][Ring1][Branch1][C][O][C][=Branch1][C][=O][/C][=C][/C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring2][Ring1][=Branch1][O][C][Ring2][Ring1][N][=O] |
CHEMBL4289434 | [C][O][C][=C][C][=C][Branch2][Ring1][Ring2][/C][=N][\N][C][=N][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][S][Ring1][#Branch2][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][Branch1] |
CHEMBL4289435 | [C][C][Branch2][Ring1][#Branch1][C][C][=N][S][C][Branch1][=N][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=N][Ring1][=N][N][C][C][C][Branch1][C][C][Branch1][C][C][N][C][Branch1][C][C][Branch1][C][C][C][Ring1][#Branch2] |
CHEMBL4289436 | [C][C][=Branch1][C][=O][N][C@@H1][C@@H1][Branch1][Ring1][C][O][O][C@@H1][Branch2][Ring1][Branch1][N][C][=N][C][=C][Branch1][=Branch1][N][Branch1][C][C][C][N][=C][N][=C][Ring1][=Branch2][Ring1][N][C@@H1][Ring2][Ring1][Ring1][O] |
CHEMBL4289437 | [C][C][O][C][=Branch1][C][=O][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][C][Ring1][P] |
CHEMBL4289438 | [C][C][Branch1][C][C][C][C][N][C][C][=C][N][Branch2][P][N][C][C@H1][O][C@@H1][O][C@@H1][C@@H1][Branch2][Ring1][Ring2][C][N][C][=C][Branch1][#Branch2][C][N][C][C][C][Branch1][C][C][C][N][=N][Ring1][N][O][C@H1][Branch2][=C][P][O][C@@H1][C@@H1][Branch2][Ring1][Ring2][C][N][C][=C][Branch1][#Branch2][C][N][C][C][C][Branch1][C][C][C][N][=N][Ring1][N][O][C@H1][Branch2][N][#Branch2][O][C@@H1][C@@H1][Branch2][Ring1][Ring2][C][N][C][=C][Branch1][#Branch2][C][N][C][C][C][Branch1][C][C][C][N][=N][Ring1][N][O][C@H1][Branch2][#Branch2][Ring1][O][C@@H1][C@@H1][Branch2][Ring1][Ring2][C][N][C][=C][Branch1][#Branch2][C][N][C][C][C][Branch1][C][C][C][N][=N][Ring1][N][O][C@H1][Branch2][#Branch1][N][O][C@@H1][C@@H1][Branch2][Ring1][Ring2][C][N][C][=C][Branch1][#Branch2][C][N][C][C][C][Branch1][C][C][C][N][=N][Ring1][N][O][C@H1][Branch2][Branch1][Branch1][O][C@@H1][C@@H1][Branch2][Ring1][Ring2][C][N][C][=C][Branch1][#Branch2][C][N][C][C][C][Branch1][C][C][C][N][=N][Ring1][N][O][C@H1][Branch1][#C][O][C@H1][Ring2][Branch2][P][C@H1][Branch1][C][O][C@H1][Ring2][=Branch2][C][O][C@H1][Branch1][C][O][C@H1][Ring2][Ring1][#Branch2][O][C@H1][Branch1][C][O][C@H1][Ring2][Ring2][S][O][C@H1][Branch1][C][O][C@H1][Ring2][=Branch1][=Branch1][O][C@H1][Branch1][C][O][C@H1][Ring2][#Branch1][N][O][C@H1][Branch1][C][O][C@H1][Ring2][=Branch2][C][O][C@H1][Branch1][C][O][C@H1][Ring2][#Branch2][Branch2][O][N][=N][Ring2][O][Ring1] |
CHEMBL4289519 | [C][C][O][C][=Branch1][C][=O][C][=C][Branch1][#C][C][=C][C][Branch1][C][C][=C][C][Branch1][C][C][=C][Ring1][Branch2][NH1][C][=C][Ring1][=N][C][=C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][O] |
CHEMBL4289520 | [C][C][=C][C][Branch1][#C][C][Branch1][Ring1][C][#N][C][=C][C][=C][C][=C][Ring1][=Branch1][F][=N][C][Branch1][=C][N][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][=N][Ring2][Ring1][=Branch2] |
CHEMBL4289521 | [C][=C][C@H1][Branch1][C][O][C][#C][C][#C][C@H1][Branch1][#Branch2][/C][=C][\C][C][C][C][C][C][C][O][C][=Branch1][C][=O][/C][=C][/C][=C][C][=C][Branch1][C][O][C][Branch1][Ring1][O][C][=C][Ring1][=Branch2] |
CHEMBL4289522 | [C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][=C][C][=N][C][Branch1][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][=C][Branch1][#C][C][N][C][C][N][N][=C][N][=C][Ring1][Branch1][C][Ring1][=Branch2][N][Ring2][Ring1][#Branch1][C][=Ring2][Ring1][O] |
CHEMBL4289605 | [F][C][=C][C][=C][C][Branch2][Ring2][O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][N][C][C][N][Branch2][Ring1][Ring2][C][C][C][C][=C][NH1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch2][Ring1][#Branch1][C][C][Ring2][Ring1][Ring1][=C][Ring2][Ring1][S] |
CHEMBL4289606 | [C][O][C][O][C][=C][C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][C][=Branch1][C][=O][C][=C][Branch2][Branch1][=N][C][=C][C][=C][Branch2][Ring2][P][O][C][C][C][C][=C][N][Branch2][Ring2][C][C][C][O][C][C][O][C][=C][C][=C][C][=Branch1][C][=O][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Ring1][=N][=C][Ring1][P][N][=N][Ring2][Ring1][N][C][=C][Ring2][Ring2][=Branch1][O][C][Ring2][Ring2][=N][=C][Ring2][Branch1][=Branch2] |
CHEMBL4289607 | [O][=C][C][=C][C][=C][C][=C][Branch2][Ring1][Ring1][O][C][C][C][C][C][C][C][C][C][C][N][C][=C][N][=C][Ring1][Branch1][C][=C][Ring2][Ring1][=Branch1][O][Ring2][Ring1][#Branch2] |
CHEMBL4289608 | [C][O][C][=C][C][=Branch1][C][=O][C][=C][Branch1][Ring1][C][O][C][Ring1][=Branch2][=O] |
CHEMBL4289609 | [C][N][C][=C][C][=C][Branch2][Ring1][=Branch2][C][O][C][=C][C][=N][N][Ring1][Branch1][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C][=N][Ring1][=Branch2][C][=C][C][Ring2][Ring1][=Branch1][=N][Ring2][Ring1][=Branch2] |
CHEMBL4289695 | [O][=C][Branch1][C][O][C][=C][C][=N][C][Branch2][Ring2][C][N][N][=C][C][=C][Ring1][Branch1][O][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][O][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=C][Ring2][Ring1][=N] |
CHEMBL4289696 | [C][O][C][=C][C][=C][Branch2][=Branch1][Branch2][/C][=C][/C][=Branch1][C][=O][O][C@H1][C][C][C@@][Branch1][C][C][C@@H1][Branch2][Ring2][=C][C][C][C@][Branch1][C][C][C@@H1][Ring1][Branch2][C][=Branch1][C][=O][C][=C][C@H1][C][C@@][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][C@][Ring1][#Branch2][Branch1][C][C][C][C][C@][Ring1][#C][Ring2][Ring1][Branch1][C][C][Ring2][Ring1][#C][Branch1][C][C][C][C][=C][Ring2][Ring2][N] |
CHEMBL4289697 | [C][C][=Branch1][C][=O][O][C@H1][C][C][C@@H1][C@H1][C][C@@H1][Branch1][C][O][C@@][Branch1][C][O][C][C][C][C][C@H1][Ring1][#Branch1][C@@H1][Ring1][N][C][C][C@][Ring2][Ring1][Ring1][Ring1][S][C] |
CHEMBL4289698 | [O][=C][Branch1][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][N][C][C][C][N][Branch2][Ring2][#Branch1][C][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][=C][C][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][N][Ring2][Ring1][=Branch1][Ring1][N][C][C][Ring2][Ring1][=C] |
CHEMBL4289699 | [O][=C][Branch2][Ring2][Ring2][/C][=C][/C][=C][C][=C][Branch1][C][O][C][O][C][Branch1][#C][C][=C][C][=C][Branch1][C][O][C][Branch1][C][O][=C][Ring1][Branch2][=C][C][Ring2][Ring1][C][=Ring1][=N][N][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL4289700 | [C][C][N][Branch1][Ring1][C][C][C][=C][C][=C][Branch2][Branch1][Branch2][/C][=C][\C][C][/C][=Branch2][Ring2][O][=C][\C][=C][C][=C][Branch2][Ring1][=C][N][Branch1][=C][C][C][O][C][C][O][C][C][O][C][C][O][C][C][C][O][C][C][O][C][C][O][C][C][O][C][C][=C][Ring2][Ring1][P][C][Ring2][Ring2][#Branch1][=O][C][=C][Ring2][Ring2][#C] |
CHEMBL4289701 | [O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Branch2][Ring1][=Branch1][C][=C][C][Branch1][=N][C][N][C][C][C][Branch1][C][O][C][C][Ring1][#Branch1][=C][Ring1][=C][O][C][C][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][O][C][=C][C][=Branch2][Ring1][Branch1][=C][C][Branch1][=N][C][N][C][C][C][Branch1][C][O][C][C][Ring1][#Branch1][=C][Ring1][=C][O][C][C][Ring2][Ring2][=N] |
CHEMBL4289790 | [C][C][Branch1][C][C][Branch2][Ring1][=Branch2][C][Branch1][C][O][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=N][N][C][C][C][S][Ring1][Branch1][=Branch1][C][=O][=O] |
CHEMBL4289791 | [O][=C][Branch1][C][O][C][N][C][=Branch1][C][=O][C][=C][C][=Branch1][C][=O][NH1][C][=C][C][=C][C][=C][Ring1][O][Ring1][=Branch1] |
CHEMBL4289792 | [O][C][C@H1][O][C@@H1][Branch2][Ring1][P][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=C][Branch1][Branch2][C][C][=C][O][C][=Ring1][Branch1][N][=C][N][=C][Ring1][O][Ring2][Ring1][Ring1][C@@H1][Branch1][C][F][C@@H1][Ring2][Ring1][=Branch2][O] |
CHEMBL4289793 | [C][C][C][C][N][C][C][C][Branch2][Ring1][N][C][O][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][C][=C][C][=C][C][=C][Ring1][=N][Ring1][=Branch1][C][C][Ring2][Ring1][#Branch1] |
CHEMBL4289794 | [C][O][C][=Branch1][C][=O][C][=C][C@H1][Branch2][=Branch1][=N][N][C][=C][Branch2][=Branch1][C][C][N][C][=Branch1][C][=O][C@][C][C][C][Branch1][C][C][Branch1][C][C][C][C@H1][Ring1][Branch2][C][=C][C][C@@H1][C@@][Branch1][C][C][C][C][C@H1][Branch1][C][O][C][Branch1][C][C][Branch1][C][C][C@@H1][Ring1][#Branch2][C][C][C@@][Ring1][=C][Branch1][C][C][C@][Ring2][Ring1][Ring1][Branch1][C][C][C][C@H1][Ring2][Ring1][=C][O][N][=N][Ring2][Ring2][Branch2][C@@H1][Branch1][#Branch1][N][C][Branch1][C][C][=O][C@H1][Branch1][O][C@H1][Branch1][C][O][C@H1][Branch1][C][O][C][O][O][Ring2][Branch1][Branch2] |
CHEMBL4289795 | [C][C][O][C][Branch1][N][C@H1][N][C][C@@H1][Branch1][C][O][C@H1][Ring1][=Branch1][O][=C][C][=Ring1][N][C][=Branch1][C][=O][N][C][C][=C][N][Branch2][Branch1][C][C][C][O][C][C][O][C][C][O][C][C][N][C][=C][Branch2][Ring1][N][C][N][C][=Branch1][C][=O][C][C][=C][Branch1][N][C@H1][N][C][C@@H1][Branch1][C][O][C@H1][Ring1][=Branch1][O][O][C][=Ring1][N][C][N][=N][Ring2][Ring1][=Branch1][N][=N][Ring2][Ring2][=Branch1] |
CHEMBL4289876 | [C][C][Branch1][Ring1][C][#N][N][C][=N][C][Branch1][O][N][C@H1][Branch1][C][C][C][C][C][Ring1][Ring1][=N][C][Branch2][Ring1][Ring1][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][Ring1][#Branch2][=N][Ring2][Ring1][=Branch1] |
CHEMBL4289877 | [C][N][C][=Branch1][C][=O][N][C][S][C][=C][Branch1][=Branch1][C][Branch1][C][C][C][C][=C][Branch1][P][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][Ring1][C][=Ring2][Ring1][=Branch1][C][Branch1][C][N][=O] |
CHEMBL4289878 | [C][N][Branch2][Ring1][S][C][C][Branch1][C][O][C][N][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][Ring1][#C][S][Branch1][C][C][=Branch1][C][=O][=O] |
CHEMBL4289879 | [C][N][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][C][Branch1][#C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Branch1][C][O][C][Ring2][Ring1][Branch2][=O] |
CHEMBL4289880 | [C][O][C][=Branch1][C][=O][C][=C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][=N][C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][=Ring1][P][C][Branch2][Ring1][Branch1][C][=C][N][Branch1][=Branch1][C][Branch1][C][C][=O][C][=C][C][=C][C][=C][Ring1][N][Ring1][=Branch1][=N][Ring2][Ring1][P] |
CHEMBL4289965 | [C][O][C][=C][C][=C][Branch2][Ring2][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][=Ring1][O][O][C][C][C][C][N][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][C][=C][Ring2][Ring1][=N][O][C] |
CHEMBL4289966 | [Cl][C][=C][C][=C][Branch2][Ring1][#Branch2][C][N][=C][C][=C][C][Branch1][C][Cl][=C][N][Ring1][#Branch1][C][=Ring1][#Branch2][C][N][C][C][S][C][C][Ring1][=Branch1][C][=C][Ring2][Ring1][#Branch1] |
CHEMBL4289967 | [C][C][N][C][C][C][Branch2][Branch1][=Branch1][C][=C][C][=C][Branch2][Ring2][#Branch2][N][C][=N][C][=C][Branch1][C][F][C][Branch2][Ring1][#Branch2][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][Branch1][C][C][Branch1][Ring1][C][C][C][Branch1][C][C][=N][Ring1][#Branch2][=N][Ring2][Ring1][Ring2][N][=C][Ring2][Ring1][O][C][C][Ring2][Ring1][P] |
CHEMBL4289968 | [C][S+1][Branch1][C][O-1][/C][=C][/C][C][N][C][=Branch1][C][=S][S][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1] |
CHEMBL4290046 | [O][=C][Branch1][C][O][C][N][C][N][Branch1][Ring2][C][C][O][C][S][C][Ring1][=Branch2][=S] |
CHEMBL4290047 | [C][C][=N][O][C][Branch1][C][C][=C][Ring1][=Branch1][C][=C][C][=C][N][=C][Branch2][Ring1][Branch1][N][C][C][N][Branch1][O][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][Ring1][N][N][=C][Branch1][=C][N][C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][Ring2][Ring1][O][=C][Ring2][Ring1][#C] |
CHEMBL4290048 | [C][C][C@H1][Branch1][C][C][C@H1][Branch1][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][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][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][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][=O][O][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][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][=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][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][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][C@@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][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][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][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@H1][Branch2][#Branch1][=Branch1][C][=Branch1][C][=O][N][C@H1][Branch2][=Branch1][Branch2][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][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][O][C@@H1][Branch1][C][C][O][C][Branch1][C][C][C] |
CHEMBL4290049 | [O][=C][Branch2][Ring1][Branch2][/C][=C][/C][=C][C][=C][Branch1][N][O][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C][=C][Ring1][=N][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][O] |
CHEMBL4290050 | [O][=C][S][/C][=Branch2][Ring1][Branch2][=C][\C][=C][C][=C][Branch1][=N][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=C][Ring1][=C][C][=Branch1][C][=O][N][Ring2][Ring1][Branch1][C][=C][C][=C][Branch2][Ring1][=Branch1][O][C][C][C][C][N][C][C][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][C][Ring1][#Branch2][C][=C][Ring2][Ring1][Branch1] |
CHEMBL4290051 | [C][O][C][=C][C][=C][Branch2][Ring1][=C][C@@H1][C][C][=Branch1][C][=O][N][Ring1][Branch1][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][N][C][=C][Ring2][Ring1][#Branch1][O] |
CHEMBL4290052 | [C][=C][C][=Branch1][C][=O][N][C@H1][Branch1][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][P][C@H1][Branch2][Ring1][Branch2][O][C][=Branch1][C][=O][C@@H1][Branch1][#Branch1][N][C][Branch1][C][C][=O][C@H1][Branch1][C][O][C][Branch1][C][C][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][Branch1][#Branch1][C@@H1][Branch1][C][C][O][C][C][=Branch1][C][=O][O][C@H1][Branch1][C][C][C@H1][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][=Branch1][C][=O][O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring2][=Branch1][C][C] |
CHEMBL4290053 | [N][#C][C][=C][C][=C][C][Branch1][=N][N][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][=C][Branch1][C][N][O][C][Ring1][=C][=C][Ring2][Ring1][C] |
CHEMBL4290054 | [C][C][C][C][O][C][=C][Branch1][Ring1][O][C][C][=C][Branch1][#Branch2][/C][=N][/N][C][=N][N][=C][Ring1][Branch1][C][=C][Ring1][#C][C][N][C][C][C][=C][C][=C][Branch1][O][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][C][Ring1][=C][O][C][O][Ring1][=Branch2] |
CHEMBL4290141 | [C][C][Branch1][C][C][C][C][Branch2][Ring1][S][O][C][=C][C][=C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][Branch2][C][C][=N][NH1][C][=Ring1][Branch1][C][=C][Ring1][O][O][N][=N][Ring2][Ring1][C][C][C][Branch1][C][C][Branch1][C][C][N][Ring2][Ring1][N] |
CHEMBL4290142 | [C][C][O][P][=Branch1][C][=O][Branch1][Ring2][O][C][C][C][Branch1][=N][N][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][=C][C][=C][C][=C][Branch1][#Branch2][C][=C][Ring1][=Branch1][NH1][C][Ring1][#Branch2][=O][O][C][O][Ring1][#Branch2] |
CHEMBL4290143 | [C][C@@H1][N][C@@H1][Branch2][Ring2][=C][C][=C][N][Branch2][Ring2][Ring1][C][C][O][C][C][O][C][C][O][C][C][N][C][=C][Branch1][#C][C@@H1][N][C@@H1][Branch1][C][C][C@@H1][Branch1][C][O][C@H1][Ring1][#Branch1][O][N][=N][Ring1][=N][N][=N][Ring2][Ring1][=N][C@H1][Branch1][C][O][C@@H1][Ring2][Ring2][Ring1][O] |
CHEMBL4290144 | [C][O][C][=C][C][=C][Branch1][=Branch2][N][C][C][C][C][C][Ring1][=Branch1][N][=C][Branch1][=Branch1][N][Branch1][C][C][C][N][=C][Ring1][#C][C][=C][Ring2][Ring1][Ring1][O][C][C][C][C][C][Ring1][Branch1] |
CHEMBL4290145 | [C][O][C][=C][C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][C][C][=N][N][Branch1][=N][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][C][C][=Ring1][=N][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][#Branch1][O][C] |
CHEMBL4290227 | [C][C][N][Branch1][Ring1][C][C][C][C][O][C][=Branch1][C][=O][/C][=C][/C][=C][C][=C][O][C][=C][Branch1][=C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][Ring1][S][=C][Ring2][Ring1][Ring2] |
CHEMBL4290228 | [C][O][C][=C][C][=C][Branch2][Ring1][#C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][=Branch1][C][=O][N][Ring1][Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][Branch2] |
CHEMBL4290229 | [O][=C][Branch2][Ring1][O][N][C][=C][C][=C][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][=N][C][=C][C][=C][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][=N] |
CHEMBL4290230 | [C][O][C][=C][C][Branch2][Ring2][Branch2][C][=N][C][Branch2][Ring1][C][/C][=C][/C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=C][C][=C][Ring1][P][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][S][O][C] |
CHEMBL4290231 | [C][C][Branch1][C][C][N][C][=Branch1][C][=O][N][C][=N][C][=N][C][=C][Ring1][=Branch1][C][=N][N][Ring1][Branch1][C][C][N][C][C][C][C][C][C][Ring1][#Branch1] |
CHEMBL4290313 | [O][=C][Branch1][=Branch2][C][=C][C][=N][N][=C][Ring1][=Branch1][N][C][C][N][Branch2][Ring2][Ring2][C][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][=C][C][=N][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=C][N][Ring2][Ring1][Ring1][Ring1][=Branch2][C][C][Ring2][Ring1][#Branch2] |
CHEMBL4290315 | [C][C][=C][C][=C][Branch2][Branch1][Ring1][C][=N][N][=C][Branch2][Ring2][Branch2][C][S][C][=C][C][Branch1][C][C][=N][C][Branch2][Ring1][#Branch1][S][C][C][=N][N][=C][Branch1][N][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][O][Ring1][N][=N][Ring2][Ring1][Branch1][O][Ring2][Ring1][N][C][=C][Ring2][Ring2][C] |
CHEMBL4290317 | [C][O][C][C][C][O][C][=C][C][=C][Branch1][#Branch1][C][=C][Ring1][=Branch1][O][C][C][=C][C][=Branch1][C][=O][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][N][Ring1][#Branch2][C@@H1][Branch1][#Branch2][C][Branch1][C][C][Branch1][C][C][C][O][C][Ring2][Ring1][#Branch1] |
CHEMBL4290408 | [O][C][=C][C][=C][Branch2][Ring2][C][C][=C][C][=C][Branch2][Ring1][#Branch1][C][=C][C][=C][Branch1][N][O][C][C][N][C][C][C][C][C][Ring1][=Branch1][C][=C][Ring1][#C][F][Se][Ring2][Ring1][Branch1][C][Branch1][C][F][=C][Ring2][Ring1][N] |
CHEMBL4290409 | [O][=S][=Branch1][C][=O][Branch1][S][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][N][C][C][N][Branch1][#C][C][=C][N][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][#Branch2][C][C][Ring1][S] |
CHEMBL4290410 | [C][C][C@H1][Branch1][C][C][C@@H1][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C@@H1][Branch1][C][C][O][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch2][C][C][=C][N][=C][NH1][Ring1][Branch1][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][C][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@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][Branch2][Ring1][=C][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][C][Branch1][C][N][=O][C][S][S][C][C@@H1][Branch2][#Branch1][=N][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][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][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][Ring2][N][Branch2][=O] |
CHEMBL4290411 | [Cl][C][=C][C][=C][Branch2][Ring2][C][C][N][=C][C][=C][C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][=C][N][Ring1][=N][C][=Ring1][S][C][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring2][Ring1][=N] |
CHEMBL4290493 | [N][C@H1][C][C][C][C][N][C][=N][C][=Branch2][Ring1][#Branch1][=N][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][N][C][C][C][C][C][C][N][C][Ring2][Ring1][S][=O] |
CHEMBL4290494 | [O][=C][C][=C][C][=C][C][=C][Branch2][Ring1][Ring1][O][C][C][C][C][N][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][C][=C][Ring2][Ring1][Ring2][O][Ring2][Ring1][Branch2] |
CHEMBL4290495 | [C][C][C][C][C][C][=C][C][=C][Branch2][Ring1][O][C][Branch2][Ring1][Ring2][O][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][=C][Ring1][P][C@@H1][C@@H1][Branch1][C][O][C][Branch1][C][C][=C][C][C@H1][Ring1][Branch2][C][Branch1][C][C][Branch1][C][C][O][Ring2][Ring1][O] |
CHEMBL4290496 | [C][=C][C][Branch1][C][C][Branch1][C][C][C][=C][Branch1][C][O][C][=C][Branch1][C][O][C][=C][Ring1][Branch2][O][C@][C][C][C@H1][Branch1][=N][C@@H1][Branch1][Ring1][O][C][C][Ring1][Branch2][C][Ring1][N][=O][C@@][Branch1][Branch2][C][C][=C][Branch1][C][C][C][Branch1][=Branch2][O][C][Ring1][S][Branch1][C][C][C][C][Ring2][Ring1][Branch1][=O] |
CHEMBL4290497 | [O][=C][Branch1][C][O][C][=C][C][=N][C][Branch2][Ring1][#Branch1][N][N][=C][Branch1][=N][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=C][Ring1][=N][O][=C][Ring2][Ring1][Ring2] |
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