chembl_id stringlengths 7 13 | selfies stringlengths 3 6.7k |
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CHEMBL4280372 | [C][=C][C][=C][Branch1][Ring2][S][Ring1][Branch1][C][C][O][C][Ring1][#Branch1][C][C][N][Branch2][Ring1][C][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][C][Ring1][#Branch1][C][C][Ring1][P] |
CHEMBL4280373 | [C][C][C][C][=Branch1][C][=O][N][N][=C][Branch1][C][C][C][Branch1][#C][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2][=C][Ring1][=C][N] |
CHEMBL4280374 | [C][O][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][C][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][=N][C][=C][Ring2][Ring1][C] |
CHEMBL4280375 | [O][=C][Branch2][Ring1][Branch1][N][C][=N][C][=C][C][=C][Ring1][=Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][N][C][=C][C][=C][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1] |
CHEMBL4280451 | [C][C][C][C][C][N][C][=Branch1][C][=O][C@@H1][C][C][=C][Branch1][N][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][C@@H1][Branch1][O][C][=C][C][=C][Branch1][C][Br][S][Ring1][=Branch1][N][Ring2][Ring1][Ring1][C][Ring2][Ring1][#Branch1][=O] |
CHEMBL4280452 | [C][C][N+1][Branch1][Ring1][C][C][Branch1][Ring1][C][C][C][C][C][C][O][C][=C][C][=C][Branch2][Ring1][Ring1][/C][=C][/C][=C][C][Branch1][Ring1][O][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][#Branch2][C][=C][Ring2][Ring1][C].[I-1] |
CHEMBL4280453 | [C][=C][Branch2][Ring1][Ring1][C][N][N][=N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][Ring1][O][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][=Branch1] |
CHEMBL4280454 | [C][C][=C][C][=C][Branch1][N][C][C][Branch1][C][N][=N][NH1][C][=Ring1][=Branch1][C][C][=C][Ring1][=N][C] |
CHEMBL4280541 | [C][N][Branch2][Ring1][C][C][C][N][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][#Branch2][C][C][N][C][=C][C][=N][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][O][Ring1][#Branch1] |
CHEMBL4280542 | [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][I][C][=C][Ring1][#Branch1][C][C][Ring2][Ring1][#Branch1] |
CHEMBL4280543 | [C][O][C][=C][C][=C][Branch3][Ring1][Ring2][Ring2][C][N][Branch2][#C][S][C][C][=Branch1][C][=O][N][Branch2][=C][#Branch2][C][C][=Branch1][C][=O][N][C][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C][Branch1][Branch1][C][C][S][C][C][=Branch1][C][=O][N][C][C][C][C][C][Branch2][#Branch2][P][N][C][=Branch1][C][=O][C][Branch1][Branch1][C][C][S][C][N][C][=Branch1][C][=O][C][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C][N][Branch1][=C][C][C][=C][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][Branch2][C][=Branch1][C][=O][C][N][Branch1][=C][C][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][=Branch1][C][=O][C][N][Branch2][Ring2][O][C][=Branch1][C][=O][C][N][Branch1][P][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][C][=Branch1][C][=O][C][N][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][N][=O][C][C][=C][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][Branch2][C][=Branch1][C][=O][C][N][Branch2][Ring2][O][C][=Branch1][C][=O][C][N][Branch1][P][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][C][=Branch1][C][=O][C][N][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][=N][N] |
CHEMBL4280544 | [C][O][C][=C][C][Branch1][Branch2][C][C][N][Branch1][C][C][C][=C][C][=Branch1][Branch1][=C][Ring1][O][O][S][S][C][Branch1][C][C][S][Ring1][=Branch2] |
CHEMBL4280545 | [C][C][=C][C][=C][C][=C][Ring1][=Branch1][/C][=C][\N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N][=O] |
CHEMBL4280633 | [C][N][C][=Branch1][C][=O][N][C][S][C][=C][Branch1][=Branch1][C][Branch1][C][C][C][C][=C][Branch2][Ring1][Ring2][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][Ring2][C][=Ring2][Ring1][#Branch1][C][Branch1][C][N][=O] |
CHEMBL4280634 | [C][O][C][=Branch1][C][=O][N][C][C][C][C][Branch2][Ring2][=Branch1][N][Branch2][Ring1][#Branch2][C][C][Branch1][C][O][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=N][S][Branch1][C][C][=Branch1][C][=O][=O][C][Ring2][Ring1][N] |
CHEMBL4280635 | [C][=C][C][=Branch1][C][=O][O][C@H1][C@H1][Ring1][=Branch1][C][C][/C][Branch2][Ring1][=Branch1][C][N][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][N][=N][Ring1][N][=C][\C][C][C@@][Branch1][C][C][O][C@@H1][Ring2][Ring1][=Branch2][Ring1][Ring2] |
CHEMBL4280710 | [C][/C][Branch1][Ring1][C][=O][=C][/C][C][/C][Branch1][C][C][=C][/C][C@@][O][C][Branch1][C][C][Branch1][C][C][C@H1][Branch1][C][Cl][C][C@][Ring1][=Branch2][Branch1][C][Cl][C][=Branch1][C][=O][C][=C][Branch1][C][O][C][=C][Branch1][C][O][C][=C][Ring1][Branch2][C][Ring2][Ring1][Branch1][=O] |
CHEMBL4280711 | [C][O][C][=C][C][=C][Branch1][#Branch1][C][=C][Ring1][=Branch1][O][C][C][N][Branch2][Ring1][#Branch2][C][C][=C][C][=C][Branch1][#C][C][=C][C][=C][Branch1][C][O][C][Branch1][C][N][=C][Ring1][Branch2][C][=C][Ring1][=C][C][C][Ring2][Ring1][=Branch2] |
CHEMBL4280712 | [C][#C][C@@][Branch1][C][O][C@@H1][Branch1][Ring1][C][O][O][C@@H1][Branch2][Ring1][O][N][C][=N][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][=C][N][=C][Ring1][=N][Ring1][S][C@@H1][Ring2][Ring1][Branch2][O] |
CHEMBL4280713 | [C][C][O][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][C][C@][Branch1][C][C][C@@H1][Ring1][Branch2][C][C][C@@][C][/C][=Branch2][Ring2][=C][=N][\O][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][O][C][Branch1][C][C][C][C][O][C][=N][O][N+1][Branch1][C][O-1][=C][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@][Branch1][C][C][Branch1][#Branch2][C][C][C@@H1][Ring2][Ring2][#Branch2][Ring2][Ring2][Branch1][C][Ring2][Ring2][=Branch1] |
CHEMBL4280714 | [O][=P][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][P][C][=C][NH1][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch2][Ring1][#Branch1][C][=C][NH1][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch2][Ring1][#Branch1] |
CHEMBL4280715 | [C][C][Branch1][C][C][O][C@@H1][C@H1][Branch1][Ring2][O][Ring1][=Branch1][C@H1][O][C][Branch1][C][C][Branch1][C][C][O][C@H1][Ring1][#Branch1][O][C@@H1][Ring1][N][C][N][C][=C][Branch1][C][Cl][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N][=O] |
CHEMBL4280793 | [C][C@@H1][C][O][C][C][N][Ring1][=Branch1][C][=C][C][Branch1][S][C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][C][Ring1][#Branch1][=N][C][Branch2][Ring1][Ring2][N][C][Branch1][C][N][=N][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][Ring1][O][=N][Ring2][Ring1][Branch2] |
CHEMBL4280794 | [C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][S][C][=Branch1][C][=O][O][C][=C][C][=C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Ring1][O][=C][Ring1][#C] |
CHEMBL4280795 | [N][C][=N][C][=N][C][=C][Ring1][=Branch1][C][Branch2][Ring1][Ring2][C][=C][C][=C][Branch1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=N][=N][N][Ring2][Ring1][C][C][C][C][C][N][Branch1][Branch2][C][=Branch1][C][=O][/C][=C][/Cl][C][Ring1][O] |
CHEMBL4280874 | [C][C][=C][C][=N][N][Ring1][Branch1][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C][=N][Ring1][=Branch2] |
CHEMBL4280875 | [C][C@][C][C][C@H1][Branch2][Ring2][#Branch2][O][C][O][C@H1][Branch1][Ring1][C][O][C@@H1][Branch2][Ring1][Branch1][O][C@@H1][O][C@H1][Branch1][Ring1][C][O][C@H1][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring1][#Branch2][O][C@H1][Branch1][C][O][C@H1][Ring2][Ring1][Branch1][O][C][C@H1][Ring2][Ring1][=N][C][C][C@@H1][C@@H1][Ring2][Ring1][P][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] |
CHEMBL4280876 | [C][C][Branch2][Ring1][N][N][C][=N][N][=C][Branch1][P][C][=C][C][=C][NH1][C][=Branch1][C][=O][NH1][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][S][Ring1][S][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL4280877 | [C][C][N][Branch1][Ring1][C][C][C][=C][C][=C][C][=C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O][C][Ring2][Ring1][Ring2][=C][Ring2][Ring1][Branch2] |
CHEMBL4280878 | [C][C][C][C][C][C][C][Branch1][C][C][S][C][Branch1][#Branch1][N][C][Branch1][C][C][=O][=N][N][Ring1][#Branch2][C][Branch1][C][C][=O] |
CHEMBL4280879 | [O][=C][Branch2][Ring1][#Branch2][N][C][=N][C][=C][C][Branch1][#Branch2][S][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][C][=C][Ring1][=N][NH1][Ring1][S][O][C][C][O][C][Ring1][Ring2] |
CHEMBL4280880 | [C][O][C][O][C][=C][C][=C][C][Branch2][Branch2][#Branch2][C][=Branch1][C][=O][O][C@H1][C@H1][C@][Branch1][C][C][Branch2][=Branch1][Branch2][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@][Ring2][Ring2][Ring2][Branch1][C][O][C][Ring2][Ring1][=C][Branch1][C][C][C][C@@H1][Branch1][C][O][C][C@H1][O][C][C@][Ring1][Ring2][Ring2][Ring2][=C][O][C][Branch1][C][C][=O][=C][Ring2][Branch1][N] |
CHEMBL4280963 | [C][O][C][=C][C][=C][Branch2][Ring1][P][C][=C][C][Branch2][Ring1][=Branch1][C][O][C][=C][C][=C][Branch1][C][F][C][Branch1][=Branch1][C][Branch1][C][N][=O][=C][Ring1][#Branch2][F][=N][O][Ring2][Ring1][C][C][=C][Ring2][Ring1][Branch2] |
CHEMBL4280964 | [C][C][=Branch1][C][=O][O][C][=C][C][=C][Branch1][=C][C][Branch1][C][C][=C][Ring1][#Branch1][O][C][Branch1][C][C][=O][C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][O][C][=C][C@@][Branch1][C][C][C][C][C@@][Branch1][C][C][C][C][C@@][Branch1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C@H1][Ring1][O][C@][Ring1][S][Branch1][C][C][C][C][C@][Ring2][Ring1][Branch1][Ring2][Ring2][Ring2][C] |
CHEMBL4280965 | [C][C@@H1][N][C@@H1][Branch2][Ring1][C][C][=C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=N][Ring1][O][C@H1][Branch1][C][O][C@@H1][Ring1][P][O] |
CHEMBL4280966 | [C][C][C][C][Branch2][Ring2][N][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][S][Branch1][C][C][=Branch1][C][=O][=O][C][Ring2][Ring1][N] |
CHEMBL4280967 | [O][C][=N][N][Branch1][=Branch2][C][C][C][N][C][C][Ring1][=Branch1][N][=C][Ring1][O][C][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL4280968 | [O][=C][Branch1][C][O][C][C][C@H1][Branch2][Branch1][Branch1][N][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring2][=Branch1][C][C][C][C][=Branch1][C][=O][N][Branch2][Ring1][Ring1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][N][=C][Ring1][#Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O] |
CHEMBL4281049 | [C][O][C][=Branch1][C][=O][C][=C][Branch1][C][C][N][=C][Branch1][C][C][C][=C][Ring1][Branch2][C][=Branch1][C][=O][C][Branch1][C][Br][=C][Branch2][Ring1][=Branch1][N][C][C@H1][O][C@@H1][O][C][Branch1][C][C][Branch1][C][C][O][C@@H1][Ring1][#Branch1][C@H1][Ring1][#Branch2][O][C][Ring2][Ring1][Branch1][=O] |
CHEMBL4281050 | [C][O][C][=C][C][Branch1][#Branch2][/C][=N][/N][C][=N][N][=C][Ring1][Branch1][=C][C][=Branch1][P][=C][Ring1][=N][O][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][N][C][C][C][=C][C][=C][Branch1][N][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][C][Ring2][Ring1][Branch2][O][C][O][Ring1][=Branch2] |
CHEMBL4281051 | [C][C][O][C][=C][C][Branch1][=N][/C][=C][\S][C][=Branch1][C][=S][N][C][Ring1][=Branch1][=O][=C][C][=C][Ring1][=C][O][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O] |
CHEMBL4281052 | [O][=C][Branch2][Ring1][Branch2][N][C][=C][C][Branch1][C][O][=C][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][=C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl] |
CHEMBL4281126 | [C][=C][Branch1][Ring2][C][N][C][C][=C][C][=C][Branch1][P][N][C][=Branch1][C][=O][C][=N][C][Branch1][Ring1][C][#N][=C][NH1][Ring1][#Branch1][C][Branch1][=Branch2][C][=C][C][C][C][C][Ring1][=Branch1][=C][Ring2][Ring1][=Branch1].[O][=C][Branch1][C][O][C][Branch1][C][F][Branch1][C][F][F] |
CHEMBL4281127 | [C][N][Branch2][Branch1][N][C][C][N][Branch1][C][C][C][C][=C][N][Branch2][Ring2][#Branch2][C][C][O][C][C][O][C][C][O][C][=C][C][=C][Branch2][Ring1][Branch1][C][=C][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][O][Ring1][N][C][=C][Ring2][Ring1][C][N][=N][Ring2][Ring1][S][C][C][=C][N][Branch2][Ring2][#Branch2][C][C][O][C][C][O][C][C][O][C][=C][C][=C][Branch2][Ring1][Branch1][C][=C][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][O][Ring1][N][C][=C][Ring2][Ring1][C][N][=N][Ring2][Ring1][S] |
CHEMBL4281128 | [C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][C][=C][Ring2][Ring1][#Branch1] |
CHEMBL4281129 | [O][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][#Branch2][C][C][C][=C][N][Branch2][Ring1][#C][C][C][O][C][=C][C][=C][C][C][=Branch1][C][=O][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Ring1][P][=Ring1][=N][N][=N][Ring2][Ring1][=Branch2] |
CHEMBL4281130 | [C][O][C][=C][C][Branch2][Ring1][S][N][/N][=C][Branch1][Ring1][\C][#N][C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][N][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][O][O][C] |
CHEMBL4281131 | [C][O][C][=C][C][=C][Branch1][#Branch2][C][=Branch1][C][=O][C][Branch1][C][Cl][Cl][C][=C][Ring1][O] |
CHEMBL4281210 | [C][C][S][C][Branch2][Ring1][Branch2][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][N][Branch1][C][C][C][C][C][=Branch1][C][=O][O][=C][C][=Ring2][Ring1][Ring2][C][=Branch1][C][=O][N][C][=N][C][=C][Branch1][C][F][S][Ring1][=Branch1].[Cl] |
CHEMBL4281211 | [O][=C][Branch1][C][O][C][=C][C][=N][C][Branch2][Ring1][#Branch2][C][=C][N][Branch1][P][C][C][N][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1][C][=N][Ring1][#C][=C][Ring2][Ring1][Branch1] |
CHEMBL4281212 | [C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Branch1][Ring1][C][=O][C][=C][Branch1][C][I][C][Ring1][Branch2][=C][Ring1][=N] |
CHEMBL4281213 | [C][N][C][=Branch1][C][=O][C][Branch1][=N][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=C][Branch1][P][C][=C][NH1][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch2][Ring1][#Branch1][C@][Ring2][Ring1][Branch2][Branch1][C][O][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1] |
CHEMBL4281298 | [O][=C][Branch1][C][O][C][=C][C][=C][C][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][C][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][Branch1][C][=C][Ring2][Ring1][#Branch2] |
CHEMBL4281299 | [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][=N][C][N][C][C][N][Branch1][C][O][C][C][Ring1][#Branch1][N][Ring2][Ring1][Branch1][C][=Ring2][Ring1][=Branch2] |
CHEMBL4281300 | [C][C][=N][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][O][=C][Ring1][N][C][=Branch1][C][=S][S][C][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL4281301 | [C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][NH1][C][=C][C][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][Branch2][N][C][=C][C][=N][Ring1][Branch1][C][=C][Ring1][O][=C][C][=C][Ring2][Ring1][Ring2][Ring2][Ring1][#Branch2] |
CHEMBL4281394 | [C][O][C][=N][C][Branch1][#Branch2][N][C][C][Branch1][C][O][C][Ring1][Branch1][=C][C][=C][Ring1][O][N][C][=N][C][=C][Branch1][C][Cl][C][Branch2][Ring1][Ring1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][S][Branch1][C][C][=Branch1][C][=O][=O][=N][Ring2][Ring1][Ring1] |
CHEMBL4281395 | [C][O][C][=C][Branch1][Ring1][O][C][C][=C][Branch1][N][C][Branch1][Ring2][C][C][N][=C][Ring1][O][S][C][S][S][S][S][S][Ring1][=C] |
CHEMBL4281396 | [O][=C][Branch1][N][N][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][Branch2][Ring1][Branch2][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][Branch1][C][Cl][=C][Ring1][Branch2][C][=C][Ring2][Ring1][Ring1] |
CHEMBL4281397 | [O][=N+1][Branch1][C][O-1][C][=C][C][Branch2][Ring2][C][N][C][C][C][C][N][Branch2][Ring1][Branch1][C][C][=C][C][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][C][Ring2][Ring1][C][=C][C][=C][Ring2][Ring1][=Branch2][C][O] |
CHEMBL4281398 | [C][C][=C][Branch2][Ring1][=N][C][=Branch1][C][=O][O][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][=N][C][Branch1][N][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][C][=C][Branch1][=C][C][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][Branch2][=O][N][Ring2][Ring2][Ring2] |
CHEMBL4281399 | [C][=C][C][=Branch1][C][=O][C@@][C@@H1][Branch1][=N][C@@H1][Branch1][C][O][C][C@@H1][Ring1][=Branch2][C@H1][Ring1][#Branch1][O][C@][C][C][C][C][Branch1][C][C][Branch1][C][C][C@H1][Ring1][Branch2][C][C@H1][Ring2][Ring1][C][O][C@@H1][Ring1][N][O][C][C][C][N][C][=C][Branch2][Ring1][N][C][N][C][=Branch1][C][=O][S][/C][=Branch1][=C][=C][\C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][Ring1][#C][=O][N][=N][Ring2][Ring1][=Branch1] |
CHEMBL4281400 | [C][C@@H1][Branch2][Branch1][=Branch1][N][C][=N][C][Branch2][Ring1][Ring2][N][C][=C][C][=N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][N][=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][=N][C][Branch1][C][F][Branch1][C][F][F] |
CHEMBL4281482 | [F][C][Branch1][C][F][C][=C][C][=N][C][Branch2][Ring2][#Branch2][C][=N][C][Branch1][#C][N][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][#Branch1][=N][C][Branch1][#C][N][C][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][#Branch1][=N][Ring2][Ring1][=Branch1][=N][Ring2][Ring1][N] |
CHEMBL4281483 | [O][=C][C][=C][Branch2][Ring1][#Branch1][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][N][O][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring2][Ring1][#Branch2][Ring1][#Branch2] |
CHEMBL4281484 | [C][O][C][=C][C][=C][C][Branch2][Ring1][Branch2][N][C][=C][C][Branch1][=N][N][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][=N][C][=N][Ring1][=C][=C][Ring2][Ring1][Branch1] |
CHEMBL4281485 | [C][C][O][C][=Branch1][C][=O][C][C][=N][N][Branch1][N][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][=Ring1][N][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Ring1][#Branch2][=O] |
CHEMBL4281572 | [C][C][Branch1][C][C][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][S][Branch1][C][C][=Branch1][C][=O][=O] |
CHEMBL4281573 | [O][=C][Branch1][C][O][C][C][C@H1][Branch2][Ring2][P][N][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring2][C][C][C][C][C][=Branch1][C][=O][N][C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O] |
CHEMBL4281574 | [C][C][Branch1][C][C][Branch1][C][C][C@@H1][Branch2][Ring2][=Branch2][O][C][=N][C][Branch2][Ring1][Branch2][O][C][=C][C][=C][C][Branch1][=N][C][=C][C][=C][C][Branch1][Ring1][C][N][=C][Ring1][Branch2][=C][Ring1][=C][=C][Branch1][C][F][C][=C][Ring2][Ring1][=Branch1][F][C][=Branch1][C][=O][O] |
CHEMBL4281575 | [C][O][C][=C][C][=C][Branch1][C][O][C][Branch2][Ring1][C][/C][=C][/C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=C][Ring2][Ring1][C] |
CHEMBL4281576 | [O][=C][Branch1][=Branch2][C][=C][N][=C][C][=N][Ring1][=Branch1][N][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][=N] |
CHEMBL4281577 | [C][N][Branch1][C][C][C][=C][C][=C][C][=C][Branch1][#C][C][#C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][F][C][=C][C][Ring1][S][=N][Ring2][Ring1][Ring2] |
CHEMBL4281661 | [N][#C][C][=C][C][=C][Branch2][Ring2][#Branch1][C][N][C][Branch2][Ring1][Branch1][/C][=C][\S][C][=Branch1][C][=S][N][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][Ring1][#Branch2][=O][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][Branch1][C][=C][Ring2][Ring1][N] |
CHEMBL4281662 | [C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring2][#C][C][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][=C][C][=C][C][Branch1][P][N][Branch1][=Branch1][C][Branch1][C][F][F][S][Branch1][C][C][=Branch1][C][=O][=O][=C][N][Ring2][Ring1][Branch2][Ring1][=C][C][C][Ring2][Ring1][#C] |
CHEMBL4281663 | [C][C][Branch1][C][C][C][C][C][=C][C][Branch1][=Branch1][C][Branch1][C][N][=S][=C][C][=N][Ring1][=Branch2] |
CHEMBL4281664 | [F][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][#C][C][=C][C][=C][C][=C][C][=C][N][=C][Ring1][#Branch2][Ring1][=Branch1] |
CHEMBL4281665 | [C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][Ring1][#Branch2] |
CHEMBL4281756 | [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][C][=C][N][=C][Ring1][#Branch1][Ring1][O][C@@H1][Ring2][Ring1][Ring1][O] |
CHEMBL4281757 | [C][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][Branch1][C][C][=C][C][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][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][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][N][=O] |
CHEMBL4281758 | [C][O][C][=C][C][Branch1][Ring1][O][C][=C][C][=Branch1][C][=O][C][Branch2][Ring1][Ring1][C][=C][C][=C][C][Branch1][=Branch2][O][C][C][=C][Branch1][C][C][C][=C][Ring1][N][=C][O][C][Ring2][Ring1][Ring1][=C][Ring2][Ring1][=Branch2] |
CHEMBL4281759 | [C][O][C][=C][C][NH1][C][=C][Branch2][Branch1][Ring2][C][Branch2][Ring1][=Branch1][C][=C][NH1][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][=N][Ring1][#Branch2][P][=Branch1][C][=O][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring2][Ring2][Branch1][C][=C][Ring2][Ring2][=Branch2][O][C] |
CHEMBL4281760 | [C][C][Branch1][C][C][N][Branch1][Branch1][C][C][C][N][C][C@H1][O][C@@H1][Branch2][Ring1][=C][N][C][=N][C][=C][Branch1][=C][N][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][N][=C][N][=C][Ring1][#C][Ring2][Ring1][C][C@H1][Branch1][C][O][C@@H1][Ring2][Ring1][Branch2][O] |
CHEMBL4281761 | [C][=C][Branch1][C][C][C@@H1][C][C][C@][Branch1][Ring1][C][O][C][C][C@][Branch1][C][C][C@H1][Branch2][Ring1][#C][C][C][C@@H1][C@@][Branch1][C][C][C][C][C][N][C][Branch1][C][C][Branch1][C][C][C@@H1][Ring1][#Branch2][C][C][C@][Ring1][=C][Ring2][Ring1][Ring1][C][C@@H1][Ring2][Ring1][=N][Ring2][Ring1][#Branch2] |
CHEMBL4281762 | [C][O][C][=C][C][=C][C][Branch2][Branch2][#Branch2][C][=Branch1][C][=O][O][C@H1][C@H1][C@][Branch1][C][C][Branch2][=Branch1][Branch2][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@][Ring2][Ring2][Ring2][Branch1][C][O][C][Ring2][Ring1][=C][Branch1][C][C][C][C@@H1][Branch1][C][O][C][C@H1][O][C][C@][Ring1][Ring2][Ring2][Ring2][=C][O][C][Branch1][C][C][=O][=C][Ring2][Branch1][N] |
CHEMBL4281763 | [O][=C][C][=C][Branch2][Branch2][Ring1][C][=C][C][=C][Branch2][#Branch1][#Branch1][O][C][C][O][C][C][O][C][C][N][C][=C][Branch2][=Branch1][Ring1][C][N][C][C][N][Branch2][Branch1][=Branch1][C][C][=C][N][Branch2][Ring2][#Branch2][C][C][O][C][C][O][C][C][O][C][=C][C][=C][Branch2][Ring1][Branch1][C][=C][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][O][Ring1][N][C][=C][Ring2][Ring1][C][N][=N][Ring2][Ring1][S][C][C][Ring2][Ring2][#Branch1][N][=N][Ring2][Ring2][=N][C][=C][Ring2][Branch1][N][O][C][=C][C][=C][Branch1][C][F][C][=C][Ring2][=Branch1][#Branch1][Ring1][#Branch1] |
CHEMBL4281849 | [C][C@@H1][Branch2][Ring1][Ring1][O][C][=C][N][=C][C][Branch1][Branch2][C][C][=N][NH1][C][=Ring1][Branch1][=C][Ring1][O][C][=C][Branch1][C][Cl][C][=C][C][Branch1][C][F][=C][Ring1][Branch2][Cl] |
CHEMBL4281850 | [C][N][Branch1][C][C][C][C][C][C][O][C][=Branch1][C][=O][N][C][=C][C][=C][Branch2][Ring1][N][C][N][N][=C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][P][=O][C][=C][Ring2][Ring1][=Branch2] |
CHEMBL4281851 | [C][C][C][Branch1][C][C][N][N][=C][N][Branch2][Branch1][S][C][=C][C][=C][Branch2][Branch1][Ring2][N][C][C][N][Branch2][Ring2][Branch2][C][=C][C][=C][Branch2][Ring1][N][O][C][C@@H1][C][O][C@@][Branch1][Ring1][C][Br][Branch1][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][O][Ring1][#C][C][=C][Ring2][Ring1][#Branch1][C][C][Ring2][Ring1][=N][C][=C][Ring2][Ring2][Ring1][C][Ring2][Ring2][Branch2][=O] |
CHEMBL4281852 | [C][C][=C][C][=C][Branch2][Ring1][#C][Se][C][C][=C][N][=C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][C][=C][Ring1][#Branch2][Se][Ring1][#C][C][=C][Ring2][Ring1][#Branch1] |
CHEMBL4281853 | [C][O][C][=Branch1][C][=O][C][C@H1][Branch2][Ring2][=Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][S][N][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][C][C][=Branch1][C][=O][O] |
CHEMBL4281854 | [C][N][Branch1][C][C][C][=Branch1][C][=N][N][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] |
CHEMBL4281855 | [C][O][C][=C][C][=C][Branch2][Ring1][Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2][C][=C][C][=C][C][=C][Ring2][Ring1][#Branch1][Ring1][=Branch1] |
CHEMBL4281926 | [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][Branch1][Ring2][C][O][C][C][Ring2][Ring1][Branch1] |
CHEMBL4281927 | [C][C][C@H1][Branch1][C][C][C@H1][Branch3][Ring1][=N][Ring2][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][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][Branch3][Ring1][Branch2][P][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][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch2][=Branch1][Ring2][C][C][C][C][N][C][=Branch1][C][=O][C][C][C@H1][Branch2][Ring2][S][N][C][=Branch1][C][=O][C][C][C][C][C][N][C][=Branch1][C][=O][C][C][/C][Branch1][C][C][=C][/C][C][=C][Branch1][C][O][C][=C][Branch1][#Branch2][C][Branch1][C][C][=C][Ring1][Branch2][O][C][C][O][C][Ring1][#Branch2][=O][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][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][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@@H1][Branch2][#Branch2][#Branch1][N][C][=Branch1][C][=O][C@@H1][Branch2][=Branch2][=Branch2][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@@H1][Branch2][=Branch1][#C][N][C][=Branch1][C][=O][C@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C@@H1][Branch2][Ring2][=N][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][N][C][C][=C][N][=C][NH1][Ring1][Branch1][C@@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][O][C][Branch1][C][C][C][C@@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C][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][Ring1][C][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C][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][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][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][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][O] |
CHEMBL4281928 | [C][C@@H1][C][C@H1][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][Ring1][C][#N][C][=N][C][=C][C][=C][Ring1][N][Ring1][=Branch1][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Ring2][C][N][Branch1][C][C][C][Ring1][#Branch1][C][Ring2][Ring1][=N] |
CHEMBL4281929 | [O][=C][C][=Branch1][C][=O][N][Branch2][Ring1][O][C][C][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][Ring1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][Ring2][Ring1][O] |
CHEMBL4282013 | [C][C][=C][C][=Branch1][C][=O][C][Branch1][C][O][=C][Branch2][Ring1][N][C][Branch1][C][O][C][=C][C][=C][Branch1][=C][C][#C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=C][Ring1][#C][O][Ring2][Ring1][=Branch2] |
CHEMBL4282014 | [C][C][C@H1][Branch1][C][C][C@H1][Branch2][Ring2][S][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][/C][=N][/O][C@H1][O][C@H1][Branch1][Ring1][C][O][C@@H1][Branch1][C][O][C@H1][Branch1][C][O][C@@H1][Ring1][#Branch2][O][C][=Branch1][C][=O][N][C@H1][Branch2][Branch1][Ring2][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][C][C][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][O][C][Branch1][C][N][=O][C@@H1][Branch1][C][C][O] |
CHEMBL4282015 | [C][C][O][C][=N][C][O][C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=C][Branch1][#Branch1][C][=Branch1][C][=O][N][C][C][=Ring1][S][C][=C][Ring2][Ring1][Ring2][C][=C][C][=C][C][Branch1][=C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][=C][Ring1][=N] |
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