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CHEMBL7762 | [C][C][C][C][C][C][C@@H1][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C@@H1][Branch1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C@H1][Ring1][N][C][=Branch1][C][=O][O][N][C][=N][C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][O][=C][Ring2][Ring1][C] |
CHEMBL3311195 | [C][C][C][N][C][=C][C][Branch1][C][C][=C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][F][=C][Ring2][Ring1][C] |
CHEMBL3311201 | [C][O][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][Branch2][Ring1][Branch1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][Branch1][C][C][=C][Ring2][Ring1][Ring2] |
CHEMBL3311210 | [O][=P][Branch1][C][O][Branch1][C][O][C][Branch2][Ring2][#C][N][C][=C][C][=C][Branch2][Ring2][C][C][C][C][=C][C][=C][Branch2][Ring1][Branch1][N][C][Branch1][=Branch2][P][=Branch1][C][=O][Branch1][C][O][O][P][=Branch1][C][=O][Branch1][C][O][O][C][=C][Ring1][S][C][=C][Ring2][Ring1][Branch2][P][=Branch1][C][=O][Branch1][C][O][O] |
CHEMBL8313 | [C][C][C@@H1][C][C][C][Branch2][Ring1][C][C][C][C][Branch1][C][C][C][=Branch1][C][=O][C][C][C][Ring1][O][Ring1][#Branch1][C][Branch1][C][C][C][=C][C][=Branch1][C][=O][C][=C][Ring2][Ring1][Branch1][Ring1][Branch2] |
CHEMBL8315 | [C][C@@H1][C][C][C][Branch2][Ring1][C][C][C][C][Branch1][C][C][C][=Branch1][C][=O][C][C][C][Ring1][O][Ring1][#Branch1][C][Branch1][C][C][C][=C][C][=Branch1][C][=O][C][=C][Ring2][Ring1][Branch1][Ring1][Branch2] |
CHEMBL8316 | [C][O][C][=C][C][=C][NH1][C][=C][Branch1][N][N][/N][=C][\C][=C][C][=C][C][=C][Ring1][=Branch1][N][=N][C][=C][Ring1][#C][C][Ring2][Ring1][C][=C][Ring2][Ring1][=Branch1] |
CHEMBL8317 | [C][O][C][=C][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][N][C][C][Branch1][C][C][N] |
CHEMBL4553715 | [C][C][=C][C][Branch1][Ring1][C][N][=C][Branch1][C][C][S][Ring1][Branch2] |
CHEMBL4553716 | [C][O][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][C][Branch1][Ring1][O][C][=C][Ring1][=C] |
CHEMBL3311348 | [C][C][=C][C][=C][Branch2][Ring2][O][C][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][Branch1][C][O][C][C@@][Branch1][C][C][Branch1][C][N][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C][Branch1][C][C][=C][Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][=C] |
CHEMBL7802 | [C][C][N][Branch1][Ring1][C][C][C][C][N][C][=C][C][=C][N][=C][N][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][C][Ring1][P][=C][Ring1][#C][Ring1][N] |
CHEMBL7803 | [O][=C][Branch1][#C][/C][=C][/C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][F][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1] |
CHEMBL4559940 | [O][=C][Branch1][=C][/C][=C][/C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=C][C][=C][Branch1][=C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][#C] |
CHEMBL4559941 | [C][S][C][C][C@@H1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@@H1][Branch2][Branch2][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][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][=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][=Branch1][C][=N][N][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][Branch1][C][C][=O][C][S][S][C][C@@H1][Branch2][#Branch1][=Branch1][C][=Branch1][C][=O][N][C@H1][Branch2][=Branch1][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@H1][Branch2][Ring2][Ring2][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][N][=O][C][Branch1][C][C][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][Branch1][C][C][S][C][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C@@H1][Branch1][C][C][O][N][C][=Branch1][C][=O][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][S][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][N][C][Ring2][=N][=N][=O] |
CHEMBL4559942 | [C][O][C][=C][C][Branch2][Branch1][C][/C][=C][/C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C@H1][Branch1][P][C][=C][C][Branch1][Ring1][O][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][#Branch2][C@@H1][Branch1][N][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][O][Ring2][Ring1][#Branch1][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring2][Ring2] |
CHEMBL4559943 | [C][C][Branch1][C][C][C][C@H1][Branch2][=Branch1][O][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][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@@H1][Branch1][C][N][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][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][Branch2][#Branch2][=Branch2][C][=Branch1][C][=O][N][C@H1][C][C][C][C][N][C][/C][=C][/C][N][C][C][C][C][C@@H1][Branch2][=Branch1][#Branch1][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@@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][=Branch1][C][Branch1][C][N][=O][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][Ring2][#Branch1][=Branch1][=O][C][Branch1][C][C][C] |
CHEMBL7806 | [C][C][C][N][Branch1][#Branch2][C][C][C][C][=C][S][C][=Ring1][Branch1][C][C][C][C][=C][Branch1][C][O][C][=C][C][=C][Ring1][#Branch1][C][Ring1][O] |
CHEMBL3311436 | [C][C][C@H1][Branch1][C][C][C@H1][Branch2][N][S][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][N][=O][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch2][C][C][=C][N][=C][NH1][Ring1][Branch1][N][C][=Branch1][C][=O][C@@H1][Branch2][Branch2][#Branch2][N][C][=Branch1][C][=O][C@@H1][Branch2][#Branch1][N][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][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=S][N][C][=C][C][=C][Branch2][Ring1][O][C][=C][C][=C][C][=Branch1][C][=O][C][=C][Ring1][#Branch1][O][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][S][Ring1][#Branch1][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring2][Ring1][=Branch2][C@@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][O][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@@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][C][=Branch1][C][=O][N][C@H1][Branch2][Branch1][Branch1][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][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][Branch1][C][N][=O][C@@H1][Branch1][C][C][C][C] |
CHEMBL7736 | [C][N][Branch1][C][C][C][=N][C][=N][C][=C][Ring1][=Branch1][N][=C][N][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N] |
CHEMBL7737 | [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][Ring1][P][C][=Branch1][C][=O][N][C][Branch2][Ring1][Ring1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][O][C][=C][Ring2][Ring1][=Branch2] |
CHEMBL7822 | [N][C][=N][C][Branch1][C][O][=C][N][=C][Branch1][C][N][N][Branch1][#Branch2][C][C][C][C][C][C][C][Ring1][=Branch1][C][Ring1][=N][=N][Ring2][Ring1][C] |
CHEMBL7823 | [C][N][Branch1][C][C][C][=N][C][=N][C][=C][Ring1][=Branch1][N][=C][N][Ring1][Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL3311087 | [C][O][C][=C][C][=C][C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][C][=N][N][=C][Branch2][Ring1][Branch2][/C][=C][/C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][N][Br][S][Ring2][Ring1][Ring2][=C][Ring2][Ring1][=N] |
CHEMBL7846 | [C][C][Branch1][C][C][C][C][C@][Branch1][#C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C@][Branch1][C][C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][C][=C][C@@][Ring1][Branch2][Branch1][C][C][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][Ring2][Branch1][C][Ring2][Ring2][#Branch2] |
CHEMBL7847 | [C][O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][C][O][C][=C][C][=C][Branch2][Ring1][C][O][C][C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][O][C][C][=C][Ring1][P] |
CHEMBL7848 | [C][C][=C][C][Branch2][Ring2][=N][C][=C][Branch1][C][F][C][=C][C][=Branch1][C][=O][C][Branch1][=N][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=C][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring2][Ring1][C][=C][Ring2][Ring1][#Branch1][F][=C][C][Branch1][C][C][=N][Ring2][Ring1][#C] |
CHEMBL7849 | [C][O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][C][O][C][=C][C][=C][Branch2][Ring1][C][O][C][C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][O][C][C][Branch1][C][F][=C][Ring2][Ring1][C] |
CHEMBL3311212 | [O][=P][Branch1][C][O][Branch1][C][O][C][Branch2][Ring2][Branch2][N][C][=C][C][=C][C][=C][Branch2][Ring1][Branch1][N][C][Branch1][=Branch2][P][=Branch1][C][=O][Branch1][C][O][O][P][=Branch1][C][=O][Branch1][C][O][O][C][=C][C][=C][Ring2][Ring1][Ring2][Ring1][S][P][=Branch1][C][=O][Branch1][C][O][O] |
CHEMBL8375 | [C][C][C][C][C][Branch1][C][C][=N][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][N][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL8376 | [S][=C][Branch1][=N][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][O][C][Branch1][=Branch2][C][N][C][=C][N][=C][Ring1][Branch1][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl] |
CHEMBL4553152 | [C][O][C][C][C][N][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][C][=N][Ring1][#Branch1] |
CHEMBL4553153 | [C][N][C][S][N][=C][Branch1][C][C][C][=Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][Branch1][=Branch1][C][Branch1][C][C][C][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2] |
CHEMBL8378 | [C][C][N][C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][S][Ring2][Ring1][Branch2][=Branch1][C][=O][=O] |
CHEMBL8379 | [C][C][=N][C][=C][Branch1][Ring2][S][Ring1][Branch1][C][N][=C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][Ring2][Ring1][Ring2] |
CHEMBL3311357 | [C][C][=C][C][=C][Branch2][Ring1][P][C][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=N][C][O][C][C@@][Branch1][C][C][Branch1][C][N][C][O][C][Branch1][C][Cl][=C][Ring1][#C][C][=C][Ring2][Ring1][#Branch2].[Cl] |
CHEMBL3311360 | [C][O][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][S][C][=C][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][Branch2][C][Ring1][=C][=O] |
CHEMBL7807 | [C][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch2][Ring1][C][N][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][O][Ring1][Branch1][C][=C][Ring1][P] |
CHEMBL7885 | [C][O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][C][O][C][=C][C][=C][C][Branch2][Ring1][C][O][C][C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][O][C][=C][Ring1][P][C] |
CHEMBL47 | [C][C][=C][Branch1][C][C][C][=C][Branch1][=Branch2][C][Branch1][C][C][=C][Ring1][Branch2][O][C][C][C@@][Branch1][C][C][Branch2][Ring1][#Branch1][C][C][C][C@H1][Branch1][C][C][C][C][C][C@H1][Branch1][C][C][C][C][C][C][Branch1][C][C][C][O][Ring2][Ring1][O] |
CHEMBL7886 | [C][C][C][C][C][C][C][C@H1][O][C][=Branch1][C][=O][C][C@@H1][Branch1][C][O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][Branch1][C][C][C][C][O][C][=Branch1][C][=O][C@H1][Ring2][Ring1][N][C] |
CHEMBL3311438 | [C][O][C@H1][/C][=C][\C][=C][Branch1][C][/C][C][=Branch1][C][=O][N][C][=C][C][=Branch1][C][=O][C][Branch2][Branch1][O][N][C][C][C][C][C][C][N][C][=Branch1][C][=S][N][C][=C][C][=C][Branch2][Ring1][O][C][=C][C][=C][C][=Branch1][C][=O][C][=C][Ring1][#Branch1][O][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][S][Ring1][#Branch1][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring2][Ring1][=Branch2][=C][Branch2][Ring2][Ring1][C][C@@H1][Branch1][C][C][C][C@H1][Branch1][Ring1][O][C][C@H1][Branch1][C][O][C@@H1][Branch1][C][C][/C][=C][Branch1][C][\C][C@@H1][Ring2][=Branch1][C][O][C][Branch1][C][N][=O][C][Ring2][Branch1][=C][=O] |
CHEMBL4553165 | [C][=C][Branch1][Ring1][C][O][C@@H1][C][C@@][Branch1][C][C][C][=Branch1][O][=C][C@H1][Branch1][C][O][C][C@@H1][Ring1][Branch2][C][C][C@H1][Ring1][=N][O] |
CHEMBL4553166 | [C][C][O][C][=Branch1][C][=O][C][C][Branch2][Ring1][N][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][C][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring2][Ring1][S][C] |
CHEMBL3311439 | [O][=C][C][=C][Branch1][C][Cl][C][=Branch1][C][=O][C][=C][Ring1][Branch2][Cl] |
CHEMBL3311440 | [O][=C][C][=C][C][=Branch1][C][=O][C][Branch1][N][C][=C][C][=C][Branch1][C][I][C][=C][Ring1][#Branch1][=C][Ring1][=C] |
CHEMBL7825 | [C][C][C][C][C][C][C][C][C][C][=Branch1][C][=O][C][=C][Branch1][C][O][C][=C][Branch1][C][C][O][C][Ring1][Branch2][=O] |
CHEMBL7826 | [C][C][C][C][C][=N][C][Branch1][Branch2][C][=Branch1][C][=O][O][C][C][=C][Branch1][Branch2][C][=Branch1][C][=O][O][C][C][N][Ring1][#C][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] |
CHEMBL7827 | [O][=C][C][Branch1][N][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][=C][O][C][=C][C][Branch1][C][O][=C][C][Branch1][C][O][=C][Ring2][Ring1][Ring1][Ring1][Branch2] |
CHEMBL7908 | [O][C][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] |
CHEMBL7909 | [C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][N][=C][Ring2][Ring1][Ring2][Ring1][=N] |
CHEMBL3311094 | [C][O][C][=C][C][Branch2][Ring1][N][/C][=C][/C][=N][N][=C][Branch1][P][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][S][Ring1][#C][=C][Branch1][C][Br][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][#Branch2][O][C] |
CHEMBL7850 | [O][C][=C][C][=C][C][Branch1][=C][C@H1][C][C][C][N][C][C][C][C][Ring1][=Branch2][Ring1][Branch1][=C][Ring1][#C] |
CHEMBL7933 | [C][C][Branch1][C][C][N][Branch2][Ring2][C][C][C][N][C][=C][C][=C][N][=C][N][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][C][Ring1][P][=C][Ring1][#C][Ring1][N][C][Branch1][C][C][C] |
CHEMBL7934 | [N][C][=N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][Ring1][P] |
CHEMBL7935 | [N][C][=N][C][Branch1][#C][C][=C][C][Branch1][C][Cl][=C][C][Branch1][C][Cl][=C][Ring1][Branch2][=C][Branch1][#C][C][=C][C][Branch1][C][Cl][=C][C][Branch1][C][Cl][=C][Ring1][Branch2][NH1][Ring2][Ring1][Branch1] |
CHEMBL3311219 | [C][C@H1][Branch1][N][C][C][C][C][Branch1][C][C][Branch1][C][C][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][Ring1][Branch2][=C][C@@H1][Ring1][S][O] |
CHEMBL8133 | [C][S][=Branch1][C][=O][=Branch1][C][=O][N][C@@H1][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][#Branch1][C][=Branch1][C][=N][N][N][C][=C][Ring1][#Branch2][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL8134 | [C][C][C][C][C][O][C][=Branch1][C][=O][C][=Branch1][C][=O][/C][=C][\C][=C][Branch1][Ring1][O][C][C][=C][Branch1][C][O][O][Ring1][=Branch2] |
CHEMBL8135 | [C][C][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][#C][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][N][=C][Ring1][Branch2][=N][O][Ring2][Ring1][S] |
CHEMBL8136 | [C][N][C][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=N][C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][=N][N][Ring2][Ring1][Ring1][Ring1][#Branch2] |
CHEMBL8137 | [N][C][Branch1][S][/C][=C][Branch1][C][\Cl][C][C][Branch1][C][N][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O] |
CHEMBL7888 | [N][C][=Branch1][C][=O][C][N][=C][N][Branch1][=N][C@H1][O][C@@H1][Branch1][Ring1][C][O][C][C@@H1][Ring1][#Branch1][O][N][=Ring1][=N] |
CHEMBL7978 | [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][O][C][=C][Ring1][#Branch1] |
CHEMBL7979 | [C][O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][C][O][C][=C][C][=C][Branch2][Ring1][C][O][C][C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][O][C][C][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][=Branch2] |
CHEMBL7910 | [C][C][=Branch1][C][=O][C][=C][C][Branch1][=N][N][C][=Branch1][C][=O][C][=C][C][=C][S][Ring1][Branch1][=C][C][=C][Ring1][=C][O][C][C][Branch1][C][O][C][N][C][Branch1][C][C][Branch1][C][C][C] |
CHEMBL7911 | [C][O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][C][O][C][=C][C][Branch2][Ring1][C][O][C][C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][O][C][=C][C][Branch1][=Branch1][C][Branch1][C][C][=O][=C][Ring2][Ring1][Ring2] |
CHEMBL7998 | [C][O][C][=C][C][=C][Branch2][Ring1][Branch1][C][=C][Branch1][C][O][C][=C][C][=Branch1][=Branch1][=C][Ring1][#Branch1][O][C][O][C][O][Ring1][Branch2][C][=C][Ring2][Ring1][C] |
CHEMBL3311106 | [C][C][=C][C][=C][Branch2][Ring2][Branch2][C][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][Branch1][C][O][C][C@@][Branch1][C][C][Branch1][C][N][C][O][P][=Branch1][C][=O][Branch1][C][O][O][C][=C][Ring2][Ring1][C][C][=C][Ring2][Ring1][=N] |
CHEMBL3311111 | [C][=C][C][C][=C][Branch2][Ring2][Ring2][C][=C][C][=C][Branch2][Ring1][Branch2][C][=C][C][=C][C][=C][Branch1][=Branch2][C][=N][C][C][C][N][Ring1][=Branch1][C][=C][Ring1][N][S][Ring1][#C][C][=C][Ring2][Ring1][Branch1][NH1][C][=Ring2][Ring1][#Branch2][C][=C][Ring2][Ring1][=C][C][=N][C][C][C][N][Ring1][=Branch1] |
CHEMBL1743869 | [C][C][C][C][O][C][=C][C][=C][Branch2][Ring1][Ring1][C@@H1][C][C][C@H1][Branch1][Ring1][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][N][C][=C][Ring2][Ring1][C].[Cl] |
CHEMBL1163184 | [O][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][#C][C][C][Branch1][C][O][C][N][C][C][C][C][C][Ring1][=Branch1][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring2][Ring1][=Branch2][Ring1][#Branch1] |
CHEMBL7673 | [C][O][C][=C][C][=C][C][Branch2][Ring1][=Branch1][O][C][=C][C][=C][Branch1][O][N][C][=Branch1][C][=O][C][C][C][Ring1][Ring1][C][=C][Ring1][N][=C][Ring2][Ring1][Ring1] |
CHEMBL3311229 | [C][C][C][C][/C][=C][/C][=C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][Ring1][#Branch2][C][=Branch1][C][=O][C][C][Branch1][C][C][C][C][=Branch1][C][=O][O] |
CHEMBL8222 | [C][O][C][=Branch1][C][=O][C][=C][C][Branch1][#Branch2][N][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Branch1][#Branch2][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][Ring2][C][=Branch1][C][=O][O][C] |
CHEMBL8223 | [C][C][N][Branch1][Ring1][C][C][C][=C][C][=C][Branch2][Ring2][=Branch2][N][C][=C][C][=C][Branch2][Ring1][#Branch1][C][=C][Ring1][=Branch1][N][C][=C][C][=C][Branch1][Branch2][N][Branch1][Ring1][C][C][C][C][C][=C][Ring1][O][C][=Branch1][C][=O][N][C][Ring2][Ring1][Ring2][=O][C][=C][Ring2][Ring1][=C] |
CHEMBL4553586 | [C][C][O][C][C][O][C][C][Branch1][C][O][C][N] |
CHEMBL4553587 | [C][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][=C][N][=C][Branch2][#Branch1][Ring2][N][C][=C][C][=C][Branch2][=Branch1][#Branch1][N][C][C][N][Branch2][Branch1][O][C][C][=C][N][Branch2][Ring2][#C][C][C][O][C][C][O][C][C][O][C][C][O][C][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][=N][C][C][C][C][=Branch1][C][=O][N][C][Ring1][#Branch1][=O][C][Ring1][=C][=O][N][=N][Ring2][Ring2][#Branch1][C][C][Ring2][Ring2][=C][C][=N][Ring2][Branch1][Ring2][N][=C][Ring2][Branch1][O][N][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][C][Ring2][=Branch1][Branch1][=O] |
CHEMBL8224 | [C][C][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][#Branch1][C][C][Branch1][C][C][N][C][=C][Ring1][N][O][C] |
CHEMBL8225 | [C][C][O][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][#Branch1][C][C][Branch1][C][C][N][C][=C][Ring1][N][O][C] |
CHEMBL3311366 | [C][O][C][=Branch1][C][=O][C][C][C][N][C][=Branch1][C][=O][C][S][C][=C][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][Branch2][C][Ring1][=C][=O] |
CHEMBL7981 | [C][O][C][=C][C][Branch1][Ring1][O][C][=C][C][=Branch1][C][=O][C][Branch1][N][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][=C][O][C][Ring1][=C][=C][Ring2][Ring1][Ring2] |
CHEMBL1163202 | [C][=C][C][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][#Branch2][O] |
CHEMBL7982 | [C][C][=C][C][=C][Branch2][Ring1][=C][/N][=C][Branch1][C][/S][O][C][Branch1][=Branch2][C][N][C][=C][N][=C][Ring1][Branch1][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][C][Branch1][C][C][=C][Ring2][Ring1][#Branch2] |
CHEMBL7715 | [N][C][=N][C][Branch1][Branch2][C][=N][C][=C][NH1][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#C] |
CHEMBL7716 | [C][N][Branch1][C][C][C][=N][C][=N][C][=C][Ring1][=Branch1][N][=C][N][Ring1][Branch1][C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2] |
CHEMBL7718 | [C][C][Branch1][C][C][Branch1][C][C][/N][=C][Branch1][Ring2][\N][C][#N][N][C][=C][C][=C][C][Branch2][Ring1][Branch1][/C][=Branch1][#Branch2][=C][/C][C][C][C][=Branch1][C][=O][O][C][=C][C][=C][N][=C][Ring1][=Branch1][=C][Ring2][Ring1][Ring2] |
CHEMBL7999 | [C][C][=C][C][Branch2][Ring2][O][C][=C][Branch1][C][F][C][=C][C][=Branch1][C][=O][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring2][Ring1][C][=C][Ring2][Ring1][#Branch1][F][=C][C][Branch1][C][C][=N][Ring2][Ring1][#C] |
CHEMBL8000 | [O][=C][C][=C][C][Branch1][#Branch2][N][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Branch1][#Branch2][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][Ring2][C][=Branch1][C][=O][N][Ring2][Ring1][Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL8001 | [O][=C][O][C][=Branch1][C][=O][C][C][C][=C][C][C][Ring1][#Branch2][Ring1][=Branch1] |
CHEMBL8002 | [C][O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][C][C][O][C][=C][C][=C][Branch2][Ring1][C][O][C][C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][O][C][C][Branch1][C][C][=C][Ring2][Ring1][C] |
CHEMBL7738 | [C][C][O][C][=Branch1][C][=O][C][=Branch1][C][=O][/C][=C][\C][=C][Branch1][Ring1][O][C][C][=C][Branch1][C][O][O][Ring1][=Branch2] |
CHEMBL7740 | [C][C][C][C][C][C][C@H1][Branch2][Ring2][Branch1][C][=Branch1][C][=O][N][C][C@@H1][Branch2][Ring1][C][O][C][=C][C][=C][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][=C][Ring1][#Branch2][C][C@H1][Ring1][S][C][=Branch1][C][=O][O][N][C][=N][C][=C][C][Branch1][P][C][=C][C][=C][C][=C][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][O][=C][C][=C][Ring1][S][Ring2][Ring1][Ring1] |
CHEMBL3311118 | [F][C][C][N][=C][Branch2][Branch1][=Branch2][C][=C][C][=C][C][=C][Branch2][Ring2][#Branch1][C][=C][C][=C][Branch2][Ring1][O][C][=C][C][=C][C][=C][Branch1][N][C][=N][C][C][Branch1][C][F][C][N][Ring1][#Branch1][C][=C][Ring1][=N][O][Ring1][S][C][=C][Ring2][Ring1][=Branch1][NH1][C][Ring2][Ring1][O][=C][Ring2][Ring1][#C][N][C][Ring2][Ring2][Branch1] |
CHEMBL1163205 | [C][=C][C][O][/N][=C][\C][C@H1][C@@H1][C][C][C][=Branch1][C][=O][C@@][Ring1][=Branch1][Branch1][C][C][C][C][C@@H1][Ring1][O][C@@][Branch1][C][C][C][C][/C][=Branch1][=Branch1][=N][\O][C][C][N][C][C@H1][Ring2][Ring1][=Branch2][Ring1][N].[O][=C][Branch1][C][O][/C][=C][/C][=Branch1][C][=O][O] |
CHEMBL7763 | [C][N][C][C][Branch2][Branch1][Branch1][O][C][C][Branch2][Ring1][P][O][C][C][Branch1][C][O][C][Branch1][C][O][C][Branch1][#Branch1][N][=C][Branch1][C][N][N][C][Branch1][C][O][C][Ring1][=N][N][=C][Branch1][C][N][N][O][C][Branch1][C][C][C][Ring2][Ring1][Branch2][Branch1][C][O][C][=O][O][C][Branch1][Ring1][C][O][C][Branch1][C][O][C][Ring2][Ring2][Branch1][O] |
CHEMBL7764 | [C][O][C@H1][C@@H1][O][C][O][C@@H1][Ring1][Branch1][C@H1][Branch1][C][O][C@@H1][Branch1][C][O][C@H1][Ring1][O][N][C][=Branch1][C][=O][/C][Branch1][C][C][=C][\C][=C][C][=C][Branch2][Ring1][Ring2][O][C@@H1][O][C@H1][Branch1][=Branch1][C][Branch1][C][C][=O][C@@H1][Branch1][C][O][C@@H1][Ring1][=Branch2][O][C][Branch1][C][O][=C][Ring2][Ring1][C] |
CHEMBL4553635 | [O][=C][Branch1][#Branch2][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C@H1][C][C@H1][C][N][Branch1][=N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][Ring1][Ring1][C][C@@H1][Ring1][=N][O][Ring1][N] |
CHEMBL4553636 | [O][C][C][=C][C][=C][Branch2][Ring1][Branch2][C][=C][N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][N][=C][Ring1][O][C][=N][Ring1][#C][C][=C][Ring2][Ring1][Branch1] |
CHEMBL4553637 | [C][O][C][=C][C][=C][NH1][C][Branch2][Branch1][Ring1][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][Branch2][Ring1][Branch1][C][C][=C][C][=C][C][Branch1][#Branch2][C][=Branch1][C][=O][N][Branch1][C][C][C][=C][Ring1][O][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][#Branch2][=C][C][Ring2][Ring1][P][=C][Ring2][Ring2][Branch1] |
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