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CHEMBL4294828 | [C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Branch1][#C][C][=C][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][C][Ring1][=C][=O][C][=Branch1][C][=O][N][Branch1][=Branch2][C][C][C][N][Branch1][C][C][C][C][Ring2][Ring1][Ring1][=O] |
CHEMBL4294829 | [F][C][=C][C][=C][Branch2][Ring1][#Branch1][C][=N][C][Branch1][=C][C][=C][C][=C][C][C][=C][NH1][C][Ring1][=Branch2][=Ring1][Branch1][=N][O][Ring1][=C][C][=C][Ring2][Ring1][Ring2][F] |
CHEMBL4294911 | [C][C][=C][C][=C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][=Branch2][C][C][N][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1][C][=N][Ring1][N][S][Ring2][Ring1][#C] |
CHEMBL4294912 | [O][=C][N][C][C][C][Ring1][Branch1][=C][C][C][=C][Branch1][C][O][C][=C][C][=Ring1][#Branch1][NH1][C][Ring1][#Branch2][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring2][Ring1][Branch1][Ring1][=Branch2] |
CHEMBL4294913 | [C][C@][C][C][C@@H1][Branch1][C][O][C][C@H1][Ring1][#Branch1][C][C][C@@H1][C@@H1][Ring1][O][C][C@@H1][Branch1][C][O][C@][Branch1][C][C][C@@H1][Branch1][O][C][=C][C][=Branch1][C][=O][O][C][Ring1][=Branch1][C][C][C@][Ring1][P][Ring1][N][O] |
CHEMBL4294914 | [O][=C][NH1][C][=C][C][=C][Branch2][Ring1][#Branch1][C][=N][N][=C][Branch1][=N][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][S][C][Ring1][=C][C][=C][Ring2][Ring1][Ring2][NH1][Ring2][Ring1][#Branch1] |
CHEMBL4294915 | [C][=C][C][=Branch1][C][=O][O][C@H1][C@H1][Ring1][=Branch1][C][C][/C][Branch2][Branch1][=Branch2][C][N][C][=C][Branch2][Ring2][=N][C][N][C][C][=C][N][Branch2][Ring1][#C][C][/C][=C][/C][C][C@@][Branch1][C][C][O][C@H1][Ring1][Ring2][C@H1][O][C][=Branch1][C][=O][C][=Branch1][C][=C][C@@H1][Ring1][#Branch1][C][C][Ring1][P][N][=N][Ring2][Ring1][#Branch1][N][=N][Ring2][Ring1][#C][=C][\C][C][C@@][Branch1][C][C][O][C@@H1][Ring2][Ring2][N][Ring1][Ring2] |
CHEMBL4295009 | [C][N][C][C][N][Branch2][Ring1][P][C][C][C][C][O][C][=C][C][=C][Branch1][P][/C][=C][\C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O][C][=C][Ring2][Ring1][C][C][C][Ring2][Ring1][=N] |
CHEMBL4295010 | [O][=C][Branch2][Ring1][P][/C][=C][/C][=C][C][=C][Branch2][Ring1][Ring1][O][C][=C][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][O][Ring1][=Branch1][C][=C][Ring2][Ring1][C][/C][=C][/C][=C][C][=C][N][=C][Ring1][=Branch1] |
CHEMBL4295011 | [N][C][=C][C][Branch1][=Branch2][C][=C][N][=C][N][=C][Ring1][=Branch1][=C][NH1][C][Ring1][N][=O] |
CHEMBL4295012 | [C][O][C][=C][C][=C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][N][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][Ring2] |
CHEMBL4295098 | [C][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][/C][=C][/C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1] |
CHEMBL4295099 | [F][C][Branch1][C][F][C][C][C][Branch2][Ring2][S][N][C][=N][C][Branch1][S][N][C][C][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring1][Branch2][=N][C][Branch2][Ring1][C][C][=C][S][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][Ring1][=Branch2][=N][Ring2][Ring1][Branch2][C][C][Ring2][Ring1][S] |
CHEMBL4295100 | [C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring2][=Branch1][N][N][=C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][=Branch1][=O][C][=C][Ring2][Ring1][=N] |
CHEMBL4295176 | [C][#C][C@@][Branch1][C][O][C@@H1][Branch1][Ring1][C][O][O][C@@H1][Branch2][Ring1][Ring2][N][C][=C][Branch1][C][I][C][=C][Branch1][C][N][N][=C][N][=C][Ring1][#Branch1][Ring1][O][C@@H1][Ring2][Ring1][Ring1][O] |
CHEMBL4295177 | [O][=C][Branch2][Ring1][=C][N][C][=C][N][=C][C][Branch2][Ring1][C][C][=C][C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][=C][S][Ring1][O][=C][Ring1][P][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F] |
CHEMBL4295178 | [C][C][C][C][C][C][C][N+1][Branch1][C][C][Branch1][C][C][C@H1][C][C][C@H1][Branch2][=Branch1][#Branch2][O][C@H1][C][C][C][C@H1][Branch1][Ring1][C][C][O][C][=Branch1][C][=O][C][C@@H1][C][=Branch2][Ring2][N][=C][C@@H1][C@H1][Ring1][Branch1][C][=C][C@@H1][C][C@@H1][Branch2][Ring1][#Branch1][O][C@@H1][O][C@@H1][Branch1][C][C][C@H1][Branch1][Ring1][O][C][C@@H1][Branch1][Ring1][O][C][C@H1][Ring1][O][O][C][C][C@@H1][Ring2][Ring1][#Branch1][Ring2][Ring1][Ring1][C][=Branch1][C][=O][C@@H1][Ring2][Ring2][Branch2][C][O][C@@H1][Ring2][Ring2][S][C].[I-1] |
CHEMBL4295179 | [C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][O][C][C][C][C][N][C][Branch1][C][C][C][O] |
CHEMBL4295180 | [C][C][C][Branch1][C][C][Branch1][C][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N][=O] |
CHEMBL4297255 | [C][O][C][=Branch1][C][=O][C][Branch2][Ring1][=Branch2][O][C][=Branch1][C][=O][C][=C][N][=C][N][Ring1][Branch1][C@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring2][Ring1][Ring1] |
CHEMBL4297257 | [C][C][C@H1][Branch1][C][C][C@H1][Branch3][Ring1][=Branch1][C][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][NH1][C][=N][Ring1][Branch1][N][C][=Branch1][C][=O][C@@H1][Branch3][Ring1][C][Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch2][Ring2][Ring1][C][C][C][C][N][C][=Branch1][C][=O][C][O][C][C][O][C][C][N][C][=Branch1][C][=O][C][C][N][C][=Branch1][C][=O][C][=C][C][Ring1][=Branch1][=O][N][C][=Branch1][C][=O][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][#Branch1][C][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@@H1][Branch2][=Branch2][#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][N][C][=Branch1][C][=N][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][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][Ring1][C][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][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][Branch2][C][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][=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][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][#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][N][=O] |
CHEMBL4297258 | [C][=C][C][=Branch1][C][=O][N][C][=C][C][Branch2][Ring1][N][N][C][=N][C][=C][C][Branch1][P][C][=C][N][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][=N][Ring1][S][=C][Branch1][O][O][C][C][Branch1][C][F][Branch1][C][F][F][N][=C][Ring2][Ring1][=N][N][Branch1][C][C][C][C][N][Branch1][C][C][C] |
CHEMBL4297260 | [C][C][C@H1][Branch1][C][C][C@H1][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][=Branch1][C][=O][N][C@H1][C][S][S][C][C@@H1][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C@H1][Branch1][=Branch1][C][Branch1][C][N][=O][C@@H1][Branch1][C][C][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][=Branch2][C][C][=C][N][=C][NH1][Ring1][Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C][N][Branch1][C][C][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][#Branch1][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@H1][Branch2][Ring1][C][C][C][=C][N][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][Branch1][C][C][C][N][C][Ring2][Branch2][Branch2][=O] |
CHEMBL4297283 | [C][C][C][C][N][C][C@H1][Branch1][=Branch2][O][C][=Branch1][C][=O][C][C][C][C@@H1][Branch1][=Branch2][O][C][=Branch1][C][=O][C][C][C][C@H1][Branch1][=Branch2][O][C][=Branch1][C][=O][C][C][C][C@H1][Ring2][Ring1][Branch2][C][O][C][=Branch1][C][=O][C][C][C] |
CHEMBL4297378 | [C][C][=C][C@@H1][C][N][Branch1][P][C][=Branch1][C][=O][N][Ring1][=Branch1][O][S][=Branch1][C][=O][=Branch1][C][=O][O-1][C@@H1][Ring1][=C][C][Branch1][C][N][=O].[Na+1] |
CHEMBL4297382 | [C][C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][O] |
CHEMBL4297384 | [C][C][N][N][=C][C][=C][Branch1][#Branch2][N][C][C][C][O][C][C][Ring1][=Branch1][C][Branch2][Ring1][=Branch1][C][=N][N][=C][Branch1][=N][C][C][S][C][Branch1][C][C][=N][C][=Ring1][=Branch1][C][O][Ring1][=N][=C][N][=C][Ring2][Ring1][#Branch2][Ring2][Ring1][=N] |
CHEMBL4297386 | [C][O][C][C][O][C][=C][C][Branch2][Ring2][N][C][N][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][=Branch1][=C][C][Branch1][=Branch1][O][C][C][O][C][=C][Ring2][Ring2][C] |
CHEMBL4297388 | [C][C@@H1][C][C@H1][C@@H1][C][C@H1][Branch1][C][F][C][=C][C][=Branch1][C][=O][C][=C][C@][Ring1][#Branch1][Branch1][C][C][C@@][Ring1][=N][Branch1][C][F][C@@H1][Branch1][C][O][C][C@][Ring2][Ring1][Ring1][Branch1][C][C][C@@][Ring2][Ring1][#Branch1][Branch2][Ring1][Branch1][O][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][Branch1][Branch1][C][C][C][C][=Branch1][C][=O][O][C][C][#N] |
CHEMBL4297626 | [C][N][N][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2][C][=C][Ring2][Ring1][=Branch2][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][O][C][Ring1][O] |
CHEMBL4297629 | [C][O][C][=C][C][=C][Branch2][Ring2][=N][C@@H1][Branch1][C][O][C][=C][C][Branch2][Ring1][=Branch2][C][=N][C][=N][C][=C][C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][=C][C][=C][Ring1][S][Ring1][N][=C][Branch1][C][F][C][=C][Ring2][Ring1][#Branch1][Cl][N][=N][Ring2][Ring1][S] |
CHEMBL4297631 | [C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][C][O][N][C][Branch1][Branch1][C][C][C][C][=N][C][=C][Branch1][C][N][N][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][O][Ring2][Ring1][C] |
CHEMBL4297632 | [C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C@H1][C][C][C][Branch1][C][O][C@H1][C][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C@@][Ring1][=N][Branch1][#Branch1][C][C][N][Ring1][=C][C][C@H1][Ring2][Ring1][Branch1][O][Ring1][=Branch2] |
CHEMBL4297633 | [C][C][Branch1][C][C][O][C][=Branch1][C][=O][C][C][C][C@H1][C][C][C@H1][C@H1][Branch2][Ring1][=N][C][C@@H1][Branch1][C][O][C@@H1][Ring1][=Branch1][/C][=C][/C@@H1][Branch1][C][O][C][O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][F][O][C][Ring2][Ring1][=Branch2] |
CHEMBL4297635 | [C][C][C][C][C][C][=C][C][=C][C][Branch1][#Branch1][C][C][=Branch1][C][=O][O][=C][Ring1][#Branch2] |
CHEMBL4293959 | [C][O][C][=Branch1][C][=O][/C][=Branch1][#Branch2][=C][/C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][P][=Branch1][C][=O][Branch1][C][O][O] |
CHEMBL4293960 | [C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Branch1][Ring1][C][#N][=C][Branch1][C][N][O][C][NH1][N][=C][Branch1][C][C][C][=Ring1][=Branch1][Ring1][=N] |
CHEMBL4293961 | [C][O][C][=C][C][=C][C][=Branch1][C][=O][C][Branch1][=N][O][C][C][C][N][C][C][C][C][C][Ring1][=Branch1][=C][Branch1][P][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][#Branch2][O][C][Ring2][Ring1][O][=C][Ring2][Ring1][#C] |
CHEMBL4293962 | [O][=C][C][=C][C][=C][Branch2][Branch1][=C][O][C][C][C][C][C][=C][N][Branch2][Ring2][=C][C][C][O][C][C][O][C][=C][C][=C][Branch2][Ring1][N][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][=Ring1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][=Branch2][N][=N][Ring2][Ring2][Ring2][C][=C][Ring2][Ring2][#C] |
CHEMBL4293963 | [C][C][Branch1][C][C][C][C@@H1][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][C][C][C][Ring1][Branch1][=C][C][=C][Branch1][P][S][C@][Ring1][Branch1][Branch1][C][C][C@@][Ring1][=N][Branch1][C][C][S][Ring1][P][C][=Branch1][C][=O][C@H1][C][C][C][N][Ring1][Branch1][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][=Branch1][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][#Branch1][C][C][Branch1][C][C][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][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][Ring2][=Branch2][Branch2][=O] |
CHEMBL4293964 | [C][C][C][Branch1][C][C][C][C][C][C][C][C][C][C@@H1][Branch1][C][O][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][C][C][C][=Branch1][C][=O][O] |
CHEMBL4294040 | [O][=C][C][=C][Branch1][=N][C][=C][C][=C][Branch1][Ring1][C][Cl][C][=C][Ring1][Branch2][O][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring2][Ring1][=Branch1][Ring1][#Branch2] |
CHEMBL4294041 | [O][=C][Branch1][#Branch2][N][C][C][C][C][C][C][Ring1][=Branch1][C][=C][C][Branch2][Ring1][=Branch1][O][C][=C][C][=C][Branch1][O][/C][=C][/C][=C][C][=C][C][=N][Ring1][=Branch1][C][=C][Ring1][=C][=C][C][=N][Ring2][Ring1][Branch1] |
CHEMBL4294042 | [O][=C][Branch1][=N][N][C][=N][C][Branch1][Ring1][C][O][=C][S][Ring1][#Branch1][C][=C][C][=C][Branch2][Ring1][Ring1][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][F][Branch1][C][F][F][S][Ring1][P] |
CHEMBL4294043 | [C][C][Branch1][C][C][=C][C][C][=C][Branch2][Ring1][Branch2][O][C][C][=C][N][Branch1][=N][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][N][=N][Ring1][=N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][#Branch2][=O] |
CHEMBL4294118 | [C][O][C][=C][C][=C][C][=C][Branch1][Branch2][NH1][C][Ring1][Branch1][=C][Ring1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][Ring1][#C] |
CHEMBL4294119 | [N][#C][C][=C][N][=C][Branch1][=N][N][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][N][=C][Ring1][=C][N][C][C@H1][C][C][C@H1][Branch1][C][N][C][C][Ring1][#Branch1] |
CHEMBL4294120 | [C][N][C][Branch1][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][=C][S][/C][Ring1][=N][=N][/N][=C][/C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2] |
CHEMBL4294121 | [N][C][=N][C][O][C][=C][C][Branch1][=Branch2][C][=C][C][C][C][C][Ring1][=Branch1][=C][C][=C][Ring1][N][C][=Branch1][C][=O][C][=Ring1][P][C][=C][Ring2][Ring1][Branch1][C][=Branch1][C][=O][O] |
CHEMBL4294122 | [C][O][C][=C][C][=C][C][Branch2][Ring1][Branch1][N][C][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][=N][=N][C][Branch2][Ring1][Ring2][N][C][C][N][C][=Branch1][C][=O][C][C][C][C][C][C][=Branch1][C][=O][N][O][=N][C][Ring2][Ring2][Ring1][=C][Ring2][Ring2][#Branch1] |
CHEMBL4294203 | [C][O][C][=C][C][Branch2][Ring1][S][N][C][Branch1][C][C][C][C][C][N][C][=Branch1][C][=O][N][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][=C][N][=C][C][=C][C][Ring1][=Branch1][=C][Ring2][Ring1][#C] |
CHEMBL4294204 | [C][O][C][=C][C][Branch1][Ring1][O][C][=C][Branch2][Ring2][Branch1][/C][=C][/C][=Branch1][C][=O][C][=C][Branch1][Ring1][O][C][C][=C][Branch1][Ring1][O][C][C][Branch1][N][C][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][=C][Ring1][P][O][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][S].[Cl] |
CHEMBL4294205 | [C][C][=C][C][Branch2][Ring1][N][O][C][C][=N][N][=C][Branch1][P][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][#C][=C][C][O][C][=Branch1][C][=O][C][=C][Branch1][C][C][C][Ring2][Ring1][=N][=Ring1][Branch2] |
CHEMBL4294206 | [C][O][C][=C][C][=C][Branch2][Ring1][#Branch1][C][=N][C][Branch1][C][N][=N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][=N][C][C][=C][Ring2][Ring1][Ring2] |
CHEMBL4294306 | [Cl].[O][=C][Branch2][Ring1][#Branch1][C][C][C][N][C][C][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][=N][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][N] |
CHEMBL4294307 | [C][C][Branch1][C][C][=C][C][N][C][=Branch1][C][=O][/C][=Branch2][Ring1][#Branch2][=N][/N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][O] |
CHEMBL4294308 | [S][=C][Branch2][Ring1][#Branch2][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][N][C][C][C][Ring1][Ring1] |
CHEMBL4294309 | [C][O][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][C][=C][Ring2][Ring1][Ring1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL4294395 | [O][=S][=Branch1][C][=O][N][Branch2][Ring1][S][C][C][Branch1][C][O][C][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][Ring1][#C][C][C][N][Ring2][Ring1][=Branch2][C][C][C][C][C][Ring1][Branch1] |
CHEMBL4294396 | [F][C][Branch1][C][F][C][C][C][Branch2][Ring2][P][N][C][=N][C][Branch1][S][N][C][C][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring1][Branch2][=N][C][Branch2][Ring1][Ring1][C][=C][C][=N][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][Ring1][#Branch2][=N][Ring2][Ring1][=Branch2][C][C][Ring2][Ring1][P] |
CHEMBL4294397 | [C][C][=C][C][Branch1][#C][O][C][=N][C][=C][C][O][C][=C][C][Ring1][=Branch2][=Ring1][Branch1][=C][C][=C][Ring1][S][C][=C][C][=C][C][=N][C][=C][N][Ring1][=Branch2][Ring1][Branch1] |
CHEMBL4294398 | [C][C][=C][C][=C][O][C][Branch2][Branch1][P][C][=C][C][=C][Branch2][Branch1][Branch1][O][C][C][O][C][C][O][C][C][N][C][=C][Branch2][Ring1][P][C][C][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][O][C][=C][Ring2][Ring2][#Branch2][=C][C][=Branch1][C][=O][C][Ring2][Ring2][P][=C][Ring2][Branch1][Branch1] |
CHEMBL4294399 | [C][C][=C][C][Branch2][Ring2][Ring1][C][=N][C][=C][C][C][Branch1][S][N][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2][=C][Branch1][C][N][O][C][Ring2][Ring1][Ring1][=Ring1][#C][=C][C][=N][Ring2][Ring1][=Branch2] |
CHEMBL4294482 | [C][=C][Branch1][C][C][C][=C][N][=C][N][Branch2][Ring2][C][C][C][Branch1][C][O][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C@@H1][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring2][Ring1][C][C][=Branch1][C][=O][C][Ring2][Ring1][#Branch2][=N][N][Ring2][Ring1][=N][C] |
CHEMBL4294483 | [C][O][C][=C][C][Branch2][Ring1][#Branch1][C][=C][Branch1][=N][C][=C][C][=C][Branch1][Ring1][S][C][C][=C][Ring1][Branch2][C][=N][N][Ring1][=N][C][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][=Branch1][O][C] |
CHEMBL4294484 | [C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][N][Branch2][Branch1][#C][C][=Branch1][C][=O][O][C@H1][C][C][C@][Branch1][C][C][C@H1][C][C][C@@][Branch1][C][C][C@@H1][Branch2][Ring1][#Branch2][C][C@@H1][O][C@][Branch1][O][C][C][C@H1][Branch1][C][C][C][O][Ring1][#Branch1][C@@H1][Branch1][C][C][C@@H1][Ring1][N][Ring1][S][C@@H1][Ring2][Ring1][Ring2][C][C][C@@H1][Ring2][Ring1][=Branch2][C][Ring2][Ring1][=N][C][C][Ring2][Ring2][=Branch1] |
CHEMBL4294485 | [C][O][C][=C][C][=C][Branch1][P][O][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][N][=O][C][=C][Ring1][=Branch2][C][=C][Ring1][S] |
CHEMBL4294486 | [O][=S][=Branch1][C][=O][C][C][C][N][Ring1][=Branch1][C][C][Branch1][C][O][C][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][Ring1][#C] |
CHEMBL4294488 | [C][O][C][=C][C][Branch2][Branch1][#Branch1][C@@H1][C][=C][C][=C][Branch2][Ring2][=Branch2][C][=C][Ring1][=Branch1][C@@H1][Branch2][Ring1][Ring2][C][C][C][Branch1][C][S-1][N][N][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C@H1][C][O][C][=Branch1][C][=O][C@H1][Ring2][Ring1][O][Ring1][=Branch1][O][C][O][Ring2][Ring1][O][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring2][=Branch1][O].[K+1] |
CHEMBL4294489 | [C][O][C][=Branch1][C][=O][C][=C][C@H1][Branch2][Branch1][S][N][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][C@H1][Branch1][#Branch1][N][C][Branch1][C][C][=O][C@H1][Branch2][Ring1][#Branch2][C@H1][Branch1][#Branch1][O][C][Branch1][C][C][=O][C@@H1][Branch1][Branch2][C][O][C][Branch1][C][C][=O][O][C][Branch1][C][C][=O][O][Ring2][Branch1][#Branch2] |
CHEMBL4294490 | [C][C][Branch1][C][C][Branch2][=Branch1][=Branch1][C][C][=Branch1][C][=O][O][C][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C@@H1][C][C][C@][Branch1][C][C][C@H1][Branch2][Ring1][#C][C][C][C@@H1][C@H1][C@H1][O][C][C@@][Ring1][Branch1][Branch1][#Branch2][C][C][C][Ring1][#Branch1][Branch1][C][C][C][C][C][C@][Ring1][=C][Ring2][Ring1][Ring1][C][C@@][Ring2][Ring1][Branch2][Branch1][C][C][C][C][#N][C][=Branch1][C][=O][O] |
CHEMBL4294576 | [O][=C][C][=Branch1][C][=O][N][Branch2][Ring1][=N][C][C][C][C][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][C][=C][C][Branch1][C][Br][=C][C][=C][Ring1][#Branch1][Ring1][N][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][Ring2][Ring1][=N] |
CHEMBL4294577 | [C][O][C][=C][C][=C][Branch1][=Branch1][C][=C][Ring1][=Branch1][O][C][N][Branch2][Ring1][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][Ring2][Ring1][#Branch1] |
CHEMBL4294578 | [C][C][C][N][C][=Branch1][C][=N][N][C][C][C][C][C@H1][Branch2][Branch1][#Branch2][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][Ring1][C][O][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][N][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][N][=O] |
CHEMBL4294579 | [N][C][O][C][=C][N][=C][C][=C][Ring1][=Branch1][C][=Ring1][=Branch2][N][C][=C][C][=C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring1][N] |
CHEMBL4294580 | [C][C][=C][C][=C][Branch2][Ring2][=C][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][Branch2][Ring1][Branch2][O][C][C][=Branch1][C][=O][N][N][C][=Branch1][C][=O][C][C][=C][C][=Branch1][C][=O][O][C][=Ring1][#Branch1][C][Branch1][C][Cl][=C][Ring2][Ring1][#Branch1][C][=C][Ring2][Ring1][#C] |
CHEMBL4294581 | [C][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][P][C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][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][N][=O] |
CHEMBL4294664 | [C][C][C][Branch1][Ring1][C][C][C][C][Branch1][C][C][Branch1][C][C][O][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][=C][Ring2][Ring1][Ring1][Ring2][Ring1][O] |
CHEMBL4294665 | [O][=N+1][Branch1][C][O-1][C][=C][C][=C][Branch1][C][Cl][N][=C][Ring1][#Branch1][N][C][=N][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][Cl] |
CHEMBL4294666 | [C][N][C][=Branch1][C][=O][C][=C][Branch1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][O][O][C][Branch1][C][N][=C][Branch1][Ring1][C][#N][C][Ring1][#C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1] |
CHEMBL4294667 | [C][O][C][=C][C][=C][C][Branch1][=N][/C][=C][\S][C][=Branch1][C][=O][N][C][Ring1][=Branch1][=O][=C][Ring1][=C][O][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O] |
CHEMBL4294668 | [C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][C][O][C][O][C][=C][Branch1][=Branch1][C][Branch1][C][C][C][C][=C][C][=C][Ring1][=Branch2][C][Branch1][C][C][C] |
CHEMBL4294751 | [C][C][C][N][Branch2][Ring1][N][C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][C][=C][C][Branch1][C][Cl][=C][N][Ring1][S][Ring1][#Branch1][C][C][Branch1][C][C][O][Ring2][Ring1][Branch2] |
CHEMBL4294752 | [C][N][Branch1][C][C][C][C][N][Branch2][Ring1][=Branch2][C][C][C][C][C][N][Branch1][=C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=Branch2][C][Ring1][#C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1] |
CHEMBL4294753 | [C][C][Branch1][C][C][C@@H1][C][C][C@@][Ring1][=Branch1][Branch1][C][C][/C][=Branch2][Ring1][#Branch1][=N][/N][C][=N][C][Branch1][N][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][=C][S][Ring1][N][C][Ring2][Ring1][Branch1] |
CHEMBL4294754 | [C][C][Branch1][C][C][C][C][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][C][C][Branch1][C][C][Branch1][C][C][N][Ring2][Ring1][#Branch1] |
CHEMBL4294830 | [O][=C][C][=C][Branch1][P][/C][=C][/C][=C][C][Branch1][C][O][=C][C][Branch1][C][O][=C][Ring1][Branch2][O][C][=C][Ring1][S][O] |
CHEMBL4294831 | [C][#C][C][C][C][C][O][C][=C][C][=C][Branch2][Ring1][Branch1][C][=C][C][=Branch1][C][=O][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][O][Ring1][N][C][=C][Ring2][Ring1][C] |
CHEMBL4294832 | [C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][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][Branch2][=Branch2][=Branch1][C][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][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C@@H1][Branch2][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][Branch1][=Branch1][O][C][Ring1][=Branch1][=O][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][O][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][Ring2][Ring1][Ring1][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1] |
CHEMBL4294833 | [C][C][C][C][N][C][=Branch1][C][=O][C][=C][Branch2][Ring2][=N][N][=C][N][Ring1][Branch1][C][C][C][N][Ring1][=Branch1][C][C][C][=C][C][=C][Branch2][Ring1][Ring2][O][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][Ring1][N][Branch1][Branch1][C][C][C][C][C][Ring2][Ring2][#Branch1][=O] |
CHEMBL4294834 | [C][C][O][C][=N][C][=C][Branch2][Ring1][C][C][C][=C][C][=N][C][=C][C][=Branch1][C][=O][N][Ring1][#Branch1][C][=Ring1][O][C][=C][Ring1][P][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][F] |
CHEMBL4294835 | [C][N][C][=N][C][Branch2][Ring1][Ring1][C][=C][C][Branch1][=Branch2][C][N][=N][NH1][C][=Ring1][Branch1][Cl][=C][C][=N][Ring1][N][=C][Ring1][P][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][O][C][C][C][C][Ring1][Ring1] |
CHEMBL4294916 | [C][O][C][=C][C][=C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][=Branch1][C][=S][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring1][P] |
CHEMBL4294917 | [C][O][C][=C][C][=C][C][Branch2][Branch2][=Branch1][C][=Branch1][C][=O][O][C@H1][C@@H1][C@][Branch1][#Branch1][O][C][Branch1][C][C][=O][C][O][C@@H1][Ring1][Branch2][C][C@@H1][C][C@@][Ring1][Ring1][Ring1][=N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][O][C][Branch1][C][C][=O][C][=C][Branch1][C][C][C@@H1][Branch2][Ring2][Ring1][O][C][=Branch1][C][=O][C@H1][Branch1][C][O][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C@][Ring2][Ring2][#C][Branch1][C][O][C][Ring2][Ring1][N][Branch1][C][C][C][=C][Ring2][Branch1][N] |
CHEMBL4294918 | [C][O][C][=N][C][=C][Branch2][Ring2][Branch1][C][=C][C][=C][Branch2][Ring1][#Branch2][C][N][C][C][C][C][C][Branch1][=C][C][C][Branch1][C][O][Branch1][Ring2][C][Ring1][#Branch1][C][Ring1][#Branch2][C][Ring1][O][S][Ring2][Ring1][C][C][=N][Ring2][Ring1][Branch2] |
CHEMBL4294919 | [C][C][=Branch1][C][=O][O][C@@][C][O][C@@H1][Ring1][Ring2][C][C@H1][Branch1][C][O][C@@][Branch1][C][C][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][=C][Branch1][C][C][C@@H1][Branch2][Ring2][#Branch1][O][C][=Branch1][C][=O][C@H1][Branch1][C][O][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][=C][C][=C][C][Branch1][Ring1][C][O][=C][Ring1][Branch2][C][C@@][Branch1][C][O][Branch2][Ring1][=N][C@@H1][Branch2][Ring1][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Ring1][C][#N][=C][Ring1][Branch2][C@@H1][Ring2][Ring2][S][Ring2][Branch1][#Branch1][C][Ring2][Ring2][O][Branch1][C][C][C] |
CHEMBL4294920 | [C][C][Branch1][C][C][C][C@H1][N][C][=Branch1][C][=O][C@H1][Branch1][=N][C][C][C][N][Branch1][C][O][C][=Branch1][C][=N][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][=Branch1][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][Branch1][C][C][C][N][C][Ring2][Ring2][O][=O] |
CHEMBL4294921 | [N][#C][/C][Branch1][=Branch1][C][Branch1][C][N][=O][=C][/S][C][C][=Branch1][C][=O][N][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][F] |
CHEMBL4294922 | [C][O][C][=C][C][=C][Branch2][Ring2][#Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch2][Ring1][=Branch1][O][C][=C][C][=C][Branch1][O][/C][=C][/C][=C][C][=C][C][=N][Ring1][=Branch1][C][=C][Ring1][=C][=C][C][=N][Ring2][Ring1][Branch1][C][=C][Ring2][Ring1][=C] |
CHEMBL4295013 | [O][=C][Branch2][Ring1][=Branch1][N][/N][=C][/C][C][C][/C][=N][/N][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1] |
Subsets and Splits