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CHEMBL7535 | [N][C][=N][C][Branch1][C][N][=C][C][=Branch1][Ring2][=N][Ring1][#Branch1][C][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=N] |
CHEMBL7465 | [O][=C][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][=C][Ring1][=C][C][C][C][Ring2][Ring1][C][C][C][N][C][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][N] |
CHEMBL7552 | [N][#C][C][=C][C][=C][Branch2][Ring1][Branch2][C][C@H1][Branch1][#C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][Br][C][=Branch1][C][=O][O][C][=C][Ring2][Ring1][Branch1] |
CHEMBL7553 | [C][N][Branch1][C][C][C][=N][C][=N][C][=C][Ring1][=Branch1][N][=C][N][Ring1][Branch1][C][C][=C][C][=C][C][Branch1][=C][O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][=C][Ring1][=N] |
CHEMBL7554 | [C][N][Branch2][Ring1][=Branch1][C][C][=C][N][=C][N][=C][Branch1][C][N][N][=C][Branch1][C][N][C][Ring1][Branch2][=N][Ring1][N][C][=C][C][=C][Branch1][S][C][=Branch1][C][=O][N][C][Branch1][Ring1][C][N][C][=Branch1][C][=O][O][C][=C][Ring1][#C].[O][=C][Branch1][C][O][C][Branch1][C][F][Branch1][C][F][F].[O][=C][Branch1][C][O][C][Branch1][C][F][Branch1][C][F][F] |
CHEMBL7555 | [C][C][C][Branch1][Ring1][C][C][N][C][=C][C][=C][N][=C][Ring1][=Branch1][N][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2][C][C][Ring1][P] |
CHEMBL4553160 | [C][O][C][=C][C][=C][Branch2][Ring1][=C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][Branch2][C][=C][Ring2][Ring1][Branch1] |
CHEMBL4553161 | [C][C][Branch1][C][C][C][C@@H1][N][C][=Branch1][C][=O][C@H1][Branch1][Branch1][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][Branch2][Ring1][=Branch1][C][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][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][Branch1][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][Branch2][Ring1][=Branch1][C][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=C][N][C][Ring2][#Branch1][=N][=O] |
CHEMBL4553162 | [C][O][C][C][N][C][C][N][Branch2][Ring2][Ring1][C][Branch2][Ring1][Ring2][C][N][C][C][C][Branch1][=Branch2][N][C][C][C][C][C][Ring1][=Branch1][C][C][Ring1][N][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][C][Ring2][Ring1][O] |
CHEMBL4553163 | [C][C][=C][C][=C][C][Branch2][Ring1][#C][C][=C][N][Branch2][Ring1][Ring2][C][C][=C][C][=C][Branch1][=Branch2][C][=C][N][=C][N][=C][Ring1][=Branch1][C][=C][Ring1][N][N][=N][Ring2][Ring1][C][=C][Ring2][Ring1][Branch2] |
CHEMBL7576 | [C][C][Branch1][C][C][C@H1][Branch1][#C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][Br][C][=Branch1][C][=O][O] |
CHEMBL38 | [C][C][=C][Branch2][Ring1][Ring2][/C][=C][/C][Branch1][C][C][=C][/C][=C][/C][Branch1][C][C][=C][/C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring2][Ring1][Branch1] |
CHEMBL7314 | [C][C][C][C][/C][=Branch2][Ring1][=Branch1][=C][\C][N][O][C][=Branch1][C][=O][N][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][Ring1][#Branch2][=O][C][=C][C][=C][C][Branch1][P][O][C][C][=C][C][Branch1][C][Cl][=C][C][Branch1][C][Cl][=C][Ring1][Branch2][=C][Ring1][S] |
CHEMBL1163168 | [O][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][N][Ring1][#Branch2][C][C][O] |
CHEMBL7315 | [C][C][=C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][=C][C][=N][C][Branch1][C][N][=N][C][Branch1][C][N][=C][Ring2][Ring1][#Branch1][Ring1][Branch2] |
CHEMBL7696 | [O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][O][Ring1][=Branch1] |
CHEMBL7783 | [N][C][=Branch1][C][=O][C][C][C][=C][C][C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][F][=N][O][C][=Ring1][N][C][Branch1][C][Cl][=C][Ring1][P][O][Ring2][Ring1][Ring2] |
CHEMBL7784 | [C][C][Branch1][C][C][Branch2][Ring2][O][C][C][C][O][C][=C][C][=C][Branch1][P][O][C][C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][O][C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][=C][Ring2][Ring1][#Branch1][C][=Branch1][C][=O][O] |
CHEMBL7785 | [O][=C][Branch1][C][O][C][C][C][=C][C][C][Branch1][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][=N][O][C][=Ring1][N][C][Branch1][C][Cl][=C][Ring1][P][O][Ring2][Ring1][Ring2] |
CHEMBL7786 | [C][C][=Branch1][C][=O][O][C][C@H1][O][C@@H1][Branch2][=Branch1][Branch2][O][C][=Branch1][C][=O][C@][C][C][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][Branch2][C][C][=Branch1][C][=O][C][=C][C@@][Branch1][C][C][Branch2][Ring1][O][C][C][C@H1][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][C][Branch1][Ring1][C][#N][=C][C@][Ring1][S][Ring1][O][C][C@][Ring2][Ring1][=Branch1][Branch1][C][C][C][C][Ring2][Ring1][P][C@H1][Branch1][#Branch1][O][C][Branch1][C][C][=O][C@H1][Branch1][#Branch1][O][C][Branch1][C][C][=O][C@@H1][Ring2][Branch1][C][O][C][Branch1][C][C][=O] |
CHEMBL7787 | [C][C][C][C][C][Branch1][C][C][Branch1][Ring2][O][Ring1][=Branch1][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][Ring1][O][C][=Branch1][C][=O][O] |
CHEMBL7788 | [C][N][C][=C][Branch2][Ring1][Ring2][C][=N][C][C@][Branch1][O][C][N][C][C][C@@H1][Ring1][=Branch1][C][Ring1][Branch1][O][Ring1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][Ring2] |
CHEMBL3310871 | [C][C][=C][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C@H1][Ring1][=Branch2][C][C][C@@H1][Branch1][C][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] |
CHEMBL7617 | [C][N][C][C][N][Branch2][Ring1][=Branch2][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Ring1][S][C][C][Ring2][Ring1][=Branch1] |
CHEMBL7619 | [O][C][=C][C][=C][Branch1][=C][C][=C][Ring1][=Branch1][S][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][Ring1][=C] |
CHEMBL7620 | [C][C][=C][C][=C][C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][O][C][C][Branch1][C][O][C][N][C][Branch1][C][C][Branch1][C][C][C][=C][Ring2][Ring1][C] |
CHEMBL4553560 | [C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][NH1][C][=Branch1][C][=O][NH1][C][Ring1][=Branch1][=C][Ring1][#Branch2] |
CHEMBL4553561 | [O][C][C][S][C][=N][C][=Ring1][Branch1][Cl] |
CHEMBL4553562 | [C][C][C][C][C][C@@H1][Branch2][Branch1][O][C][=Branch1][C][=O][N][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring2][Branch1][C][=C][C][=C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O][C][Branch1][Ring2][O][C][C][=C][Ring2][Ring1][Ring2][O][Ring2][Ring1][=Branch2][C@@H1][Branch1][Ring1][C][C][N][Branch1][Ring1][C][=O][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Branch2][N][C][=C][N][=C][Ring1][Branch1][C][=C][Ring1][O] |
CHEMBL4553563 | [O][=C][Branch2][Branch1][C][/C][=C][/C][=C][C][=C][Branch2][Ring2][Ring2][O][C][C][=N][C][Branch2][Ring1][#Branch1][C][C][C][N][Branch1][=N][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][C][Ring1][=C][=N][O][Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][O][N][O] |
CHEMBL7621 | [C][N][Branch2][Ring2][N][C][=Branch1][C][=O][C@H1][Branch1][#C][C][C][#C][C][=C][N][=C][Branch1][C][N][N][=C][Ring1][#Branch1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][C][C][C][C][Ring1][Branch1] |
CHEMBL7622 | [C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl] |
CHEMBL7556 | [C][C][O][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][P][N][Branch1][C][C][C][=C][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][Branch2][C][=C][Ring1][S] |
CHEMBL7557 | [C][O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][C][O][C][=C][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][Branch2][O][C][C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][O][C] |
CHEMBL7640 | [C][C][=C][C][=Branch2][Ring1][=Branch1][=C][C][C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][F][=N][O][C][Ring1][S][=Ring1][N][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][O][Ring2][Ring1][Branch1] |
CHEMBL7641 | [C][C][C][C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][=Branch2][C][C][=C][C][=C][Branch1][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][=N][NH1][N][=Ring1][Branch1][C][=C][Ring1][P] |
CHEMBL7642 | [N][C][C][C@H1][Branch2][=Branch1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][S][C][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][=Branch2][C][N][C][C][C][C][Ring1][Branch1][=N][N][Branch1][=C][C][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][C][Ring2][Ring1][Ring2][=C][Ring2][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL7643 | [O][=C][Branch1][=N][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][Ring1][=Branch1] |
CHEMBL7316 | [S][C][=N][C][Branch1][C][S][=C][C][=C][Branch1][S][S][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][=C][C][Ring1][P][=N][Ring2][Ring1][=Branch1] |
CHEMBL7317 | [O][=C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][=C][C][=C][NH1][C][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2][=C][C][Ring1][S][=C][Ring2][Ring1][Ring2] |
CHEMBL423 | [C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][O][C][=C][C][=C][Branch1][#Branch2][C][C][O][C][C][C][C][Ring1][Ring1][C][=C][Ring1][=N] |
CHEMBL449 | [C][C][C][Branch1][C][C][C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][=Branch1][C][=O][N][C][Ring1][#Branch2][=O] |
CHEMBL8018 | [C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][P][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Branch1][C][N][=Branch1][C][=O][=O][C][=N][Ring1][S][C][C][Branch1][P][C][=C][C][=C][O][N][=C][Branch1][C][N][C][Ring1][=Branch1][=C][Ring1][#Branch2][=N][O][Ring2][Ring2][C] |
CHEMBL8019 | [C][C][Branch1][C][C][Branch2][Branch1][Ring2][C][C][C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][O][C][C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][O][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][=N][C][=Branch1][C][=O][O][C][C][=C][C][=C][N][=C][Ring1][=Branch1] |
CHEMBL1163204 | [C][N][C][=C][Branch2][Ring1][=C][N][C][=Branch1][C][=O][C][=C][C][Branch1][#C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][=C][N][Ring1][=N][C][C][=C][Ring2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][N][N][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#C] |
CHEMBL8020 | [O][C][=C][C][=C][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][C][=C][C][=C][Ring2][Ring1][C][C][Ring1][S][=C][Ring1][=Branch1][Ring1][=C] |
CHEMBL3310876 | [O][=C][C][C][S][C@@H1][C@@H1][Branch1][C][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@@H1][Branch1][Ring1][C][O][N][Ring1][#C][Ring1][O] |
CHEMBL3310882 | [O][N][=C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O] |
CHEMBL3310890 | [N][=C][N][C][=Branch1][C][=O][C@][Branch2][Ring1][Ring1][O][C@H1][Branch1][Ring1][C][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring1][#Branch2][O][S][Ring1][S] |
CHEMBL7355 | [C][C][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][C][Branch2][Ring1][=Branch1][/N][=C][Branch1][C][\S][N][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][=C][Ring2][Ring1][Ring1][O][Ring2][Ring1][#Branch2] |
CHEMBL7356 | [O][=C][Branch1][=C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2][C][=C][C][=C][C][Branch1][Branch2][O][C][C][C][C][C][I][=C][C][=C][Ring1][=N][NH1][Ring1][S] |
CHEMBL7357 | [C][C][Branch1][C][C][N][=C][Branch1][C][N][N][=C][Branch1][C][N][N][Ring1][=Branch2][C][=C][C][=C][C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][=C] |
CHEMBL7358 | [N][C][=N][C][Branch1][C][N][=C][C][=C][Branch2][Ring1][=Branch2][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][C][=C][C][Ring2][Ring1][Ring2][=N][Ring2][Ring1][=Branch2] |
CHEMBL7359 | [C][N][C][=N][C][=N][C][=C][Ring1][=Branch1][N][=C][N][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][F] |
CHEMBL7644 | [C][O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][O][C][Ring1][S][=Ring1][Branch2] |
CHEMBL7645 | [C][O][C][=C][C][=C][C][Branch2][Ring1][Ring1][C][=C][C][O][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][=Ring1][Branch2][Ring1][N][=C][Ring1][S] |
CHEMBL7646 | [C][S][C][N][=C][Branch1][C][O][C][=C][Branch1][=Branch1][C][Branch1][C][N][=O][NH1][N][=C][Ring1][Branch2][N][=Ring1][=N] |
CHEMBL7377 | [O][=C][Branch2][Ring1][N][N][C@@H1][Branch2][Ring1][C][C][C][=C][NH1][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch2][Ring1][#Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Br] |
CHEMBL7378 | [C][C][C][C][=C][C][=Branch1][C][=O][O][C][=C][C][=Branch2][Ring1][=Branch1][=C][C][=Branch1][=Branch1][=C][Ring1][O][Ring1][=Branch1][O][C][Branch1][C][C][Branch1][C][C][C][=C][Ring1][=Branch2][O][C@H1][Branch1][C][C][C@H1][Branch1][C][C][C][Ring1][P][=O] |
CHEMBL7379 | [C][C][C][C][NH1][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][=Ring1][O][C][C][N][Branch1][C][C][C] |
CHEMBL7403 | [N][C][=N][C][Branch1][C][N][=C][C][=C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][=C][C][Ring2][Ring1][Ring2][=N][Ring2][Ring1][=Branch2] |
CHEMBL7404 | [C][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][Branch1][C][O][N][=C][N][=C][Ring1][#Branch1][Ring1][#C] |
CHEMBL7406 | [C][C][C][C][C][C][C][C][C][C][O][C][=C][C][=C][C][=Branch2][Ring2][Branch2][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][Ring2][O][C][C][C][C][C][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][Branch1][O][C][C][C][Ring2][Ring1][#C][=O] |
CHEMBL7491 | [O][C][=C][C][=C][Branch2][Ring1][C][C][=C][Ring1][=Branch1][C][C][C][S][C][C][=C][C][=C][N][=C][Ring1][=Branch1][O][C][C][Ring2][Ring1][C] |
CHEMBL7492 | [C][O][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch2][Ring1][#Branch1][C][C][=C][N][=C][N][=C][Branch1][C][N][N][=C][Branch1][C][N][C][Ring1][Branch2][=C][Ring1][N][C][=C][Ring2][Ring1][=Branch1] |
CHEMBL7493 | [C][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][=N][N][=C][N][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][#Branch2][C][Ring1][=C][=O][C][=C][Ring2][Ring1][Branch1] |
CHEMBL7692 | [C][C][Branch1][C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1] |
CHEMBL7693 | [C][C][C][C][=C][C][=Branch1][C][=O][O][C][=C][Branch1][#Branch1][C][Branch1][C][O][C][C][C][Branch1][Ring2][O][C][C][=C][C][=Branch1][#Branch1][=C][Ring2][Ring1][C][Ring1][=N][O][C][Branch1][C][C][Branch1][C][C][C][=C][Ring1][=Branch2] |
CHEMBL7694 | [C][C][Branch1][C][C][N][C][C][Branch1][C][O][C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2] |
CHEMBL3310891 | [C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][/N][=C][/N][C][=Branch1][C][=O][C@][Branch2][Ring1][Ring1][O][C@H1][Branch1][Ring1][C][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring1][#Branch2][O][S][Ring1][S] |
CHEMBL7442 | [Cl][C][=C][C][=C][Branch2][Ring1][=Branch2][N][C][C][N][Branch1][#C][C][C][C][=N][N][C][=Ring1][Branch1][C][C][C][C][Ring1][=Branch1][C][C][Ring1][S][C][=C][Ring2][Ring1][=Branch1] |
CHEMBL7443 | [O][=C][N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=N][C][=C][C][=C][Ring1][=Branch1][Ring1][S] |
CHEMBL4553659 | [C][O][C][C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][C][N][N][=C][Branch1][C][C][C][Branch1][C][C][=C][Ring1][#Branch1][C][C][Ring1][P] |
CHEMBL4553660 | [C][N][C][C][/C][=C][/C@H1][Branch1][N][O][C][C][N][C][C][O][C][C][Ring1][=Branch1][C@@H1][C][C][C@H1][Ring1][Ring2][C][N][C][C@@][Branch1][P][C][C][C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][Ring1][O][C][O][C][=C][C][=C][Branch1][Branch2][C][=C][Ring1][=Branch1][Ring2][Ring1][Branch1][C@@][Branch1][C][O][Branch2][Ring1][C][C][=Branch1][C][=O][N][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch1][C][C][C][C][C][Ring2][Branch1][=Branch1][=O] |
CHEMBL4553661 | [C][C][O][C][=Branch1][C][=O][C][C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=C][S][C][=Ring1][N][N][C][=Branch1][C][=O][C][S][C][=N][C][=C][Branch1][O][C][Branch1][Ring1][C][C][=C][Ring1][Branch2][C][#N][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][#C] |
CHEMBL7446 | [C][O][C][=N][C][=N][C][=C][Ring1][=Branch1][N][=C][N][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL7447 | [C][=C][Branch1][C][C][C@@H1][C][C][C@][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C][C][C][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C@@H1][Branch1][C][O][C][C][=Branch1][C][=O][O][C][C][C@][Branch1][C][C][C@H1][Branch2][Ring1][P][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][Ring2][Ring1][Ring1][C][C@@H1][Ring2][Branch1][Ring1][Ring2][Ring2][S] |
CHEMBL7448 | [C][O][C][=C][C][=C][C][Branch2][Ring1][Ring1][C][=C][C][O][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][=Ring1][Branch2][Ring1][N][=C][Ring1][S][Br] |
CHEMBL7449 | [O][C][=C][C][=C][C][Branch1][#C][C][=C][C][C][N][C][C][C][C][C][Ring1][#Branch2][Ring1][=Branch1][=C][Ring1][S] |
CHEMBL7380 | [C][N][Branch1][C][C][C][C][C][N][C][=C][Branch2][Ring2][=Branch2][C][=C][Branch2][Ring1][#Branch2][C][=C][N][Branch1][#Branch2][C][C][O][C][C][O][C][C][O][C][=C][C][=C][C][=C][Ring2][Ring1][C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][Ring2][Ring1][Branch2][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring2][C] |
CHEMBL4553679 | [C][O][C][=C][C][Branch1][C][C][=C][C][O][C][=Branch1][C][=O][C][=C][Branch1][#Branch2][C][P][=Branch1][C][=O][Branch1][C][O][O][C][Ring1][P][=Ring1][N] |
CHEMBL7381 | [O][C][=C][C][=C][C][Branch1][#C][C][C][C][C][N][C][C][C][C][C][Ring1][#Branch2][Ring1][=Branch1][=C][Ring1][S] |
CHEMBL7382 | [C][N][Branch2][Ring1][=Branch1][C][C][=C][N][=C][N][=C][Branch1][C][N][N][=C][Branch1][C][N][C][Ring1][Branch2][=N][Ring1][N][C][=C][C][=C][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][N][C][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O][C][=C][Ring2][Ring1][O] |
CHEMBL7466 | [O][=C][Branch2][Ring1][=Branch1][N][C@@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Br] |
CHEMBL7467 | [C][C][Branch1][C][C][Branch1][Branch2][C][N][C][Branch1][C][N][=O][N][C][C][Branch1][C][O][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][F] |
CHEMBL7468 | [C][=C][C@@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O-1][C@H1][Ring1][#Branch1][C][C][C][C][C][C][C][C].[Na+1] |
CHEMBL7469 | [O][=C][Branch1][C][O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][Br] |
CHEMBL7495 | [O][=C][Branch2][Ring2][Ring2][O][C][=C][C][=C][NH1][C][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2][=C][C][Ring1][S][=C][Ring2][Ring1][Ring2][C][=C][C][=C][N][=C][Ring1][=Branch1] |
CHEMBL1163183 | [C][=C][C][=Branch1][C][=O][O][C@@H1][C][C@H1][Branch1][C][C][C][Branch1][Branch2][C][C][C][Branch1][C][C][=O][=C][C@H1][Branch1][#Branch1][O][C][Branch1][C][C][=O][C@H1][Ring2][Ring1][Branch1][Ring1][P] |
CHEMBL7580 | [C][C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][=Branch2][C][C][N][Branch1][C][C][C] |
CHEMBL439 | [N][C][=C][C][=C][Branch1][P][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=N][C][=C][C][=N][Ring1][=Branch1][C][=C][Ring1][S] |
CHEMBL7581 | [C][N][Branch1][C][C][C][=N][C][=N][C][=C][Ring1][=Branch1][N][=C][N][Ring1][Branch1][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1] |
CHEMBL7867 | [C][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][=C][C][C][=C][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][Branch2][C][=C][Ring1][#C] |
CHEMBL7868 | [C][C][N][N][=C][C][=C][Branch2][Ring1][C][N][C][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][C][Cl][=C][Ring1][=Branch2][C][Branch1][#C][C][=Branch1][C][=O][N][C][C][=C][C][=N][C][=C][Ring1][=Branch1][=C][N][=C][Ring2][Ring1][O][Ring2][Ring1][=C] |
CHEMBL1163195 | [C][C][O][C][=Branch1][C][=O][/C][=C][\O][C][=C][C][=C][C][=C][Ring1][=Branch1][C] |
CHEMBL1784812 | [O][=C][Branch1][P][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][N][C][C][O][C][Branch1][=Branch2][C][N][C][=C][N][=C][Ring1][Branch1][C][Ring1][N] |
CHEMBL8016 | [N].[N].[O][=C][Branch1][Ring1][C][Br][C][=C][N][Branch2][Ring1][=Branch1][C][C][C][Branch1][C][O][C][Branch1][#Branch2][O][P][=Branch1][C][=O][Branch1][C][O][O][O][Ring1][O][C][=Branch1][C][=O][NH1][C][Ring2][Ring1][C][=O] |
CHEMBL3310896 | [C][C][=C][C][=C][Branch2][Ring2][Branch2][S][=Branch1][C][=O][=Branch1][C][=O][/N][=C][/N][C][=Branch1][C][=O][C@][Branch2][Ring1][Ring1][O][C@H1][Branch1][Ring1][C][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring1][#Branch2][O][S][Ring1][S][C][=C][Ring2][Ring1][#Branch2] |
CHEMBL3310906 | [C][O][C][=Branch1][C][=O][C][=C][Branch1][C][O][C][=C][Branch1][C][O][C][Branch1][C][Cl][=C][Ring1][=Branch2][C][C][C][=Branch1][C][=O][N][C][=N][C][=C][C][=C][Ring1][=Branch1][Cl] |
CHEMBL7537 | [C][C][=Branch1][#Branch2][=C][\C][=C][C][=C][C][=C][Ring1][=Branch1][/C][=C][/S][C][=Branch1][C][=S][N][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][Ring1][#Branch2][=O] |
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