chembl_id stringlengths 7 13 | selfies stringlengths 3 6.7k |
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CHEMBL4279487 | [C][C][C][C][C@@H1][Branch2][Ring2][Ring1][N][C][=Branch1][C][=O][C][=C][C@@H1][Branch1][=Branch2][O][C][Branch1][Ring1][C][C][C][C][C@H1][Branch1][#Branch1][N][C][Branch1][C][C][=O][C@@H1][Branch1][C][N][C][Ring1][P][C][=Branch1][C][=O][O] |
CHEMBL4279573 | [C][C][O][C][=Branch1][C][=O][C][=C][N][=C][Branch1][S][N][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][N][N][=C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][N][=C][Ring2][Ring1][#Branch1][Ring1][#Branch2] |
CHEMBL4279574 | [C][C][=C][C][=C][Branch2][=Branch1][N][C][=Branch1][C][=O][/C][=C][/C][=C][C][=C][Branch2][Branch1][#Branch2][O][C][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][C][=C][C][=C][Ring1][#Branch1][O][Ring1][N][C][=C][Ring2][Ring1][C][N][=N][Ring2][Ring1][S][C][=C][Ring2][Ring2][O][C][Branch1][C][O][=C][Ring2][Branch1][=Branch1] |
CHEMBL4279575 | [C][O][C][=C][C][=C][Branch2][Ring2][=Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=C][C][=C][Ring2][Ring1][=N] |
CHEMBL4279576 | [C][O][C][C][N][C@H1][C][C][C@H1][Branch2][Ring2][Ring2][N][C][=C][C][Branch2][Ring1][Ring2][C][=C][S][C][Branch1][O][S][C][C][C][C][O][C][C][Ring1][=Branch1][=N][Ring1][=N][=C][Branch1][C][Cl][C][=N][Ring2][Ring1][Ring2][C][C][Ring2][Ring1][O] |
CHEMBL4279577 | [O][C][=C][C][=C][Branch1][=N][C][C][C][C][C][Branch1][C][O][C][C][Ring1][Branch2][C][=C][Ring1][=C] |
CHEMBL4279578 | [C][O][C][=C][C][Branch2][Ring2][=N][C][=Branch1][C][=O][/C][=C][\N][C][=C][C][=C][Branch2][Ring1][#Branch2][C][=N][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][N][S][Ring1][#C][C][=C][Ring2][Ring1][Branch1][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring2][C][O][C] |
CHEMBL4279665 | [F][C][Branch1][C][F][C][C][C@@H1][Branch2][Branch1][=Branch1][N][C][=N][C][Branch2][Ring1][Ring2][N][C][=C][C][=N][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][=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][O][C][Ring2][Ring2][C] |
CHEMBL4279667 | [F][C][=C][C][=C][Branch2][Ring1][#Branch1][C][=N][C][Branch1][=C][C][=C][C][=C][N][=C][NH1][C][Ring1][Branch1][=C][Ring1][=Branch2][=N][O][Ring1][=C][C][=C][Ring2][Ring1][Ring2][Cl] |
CHEMBL4279668 | [C][O][C][=C][C][=C][C][Branch2][Ring1][Branch1][/C][=Branch1][Ring1][=N][\O][N][C][=C][Branch1][C][I][C][=Branch1][C][=O][NH1][C][Ring1][Branch2][=O][=C][Ring2][Ring1][C] |
CHEMBL4279669 | [C][C][Branch1][C][C][C][C][C][Branch1][Branch1][C][C][Ring1][#Branch1][N][C@H1][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Branch1][=Branch1][C][Branch1][C][N][=O][O][C][Ring1][=Branch2][C@@H1][Branch1][=N][C][=C][C][=N][C][Branch1][C][Cl][=C][Ring1][#Branch1][F][C@@][Ring2][Ring1][O][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][Ring1][O].[C][C][=C][C][=C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][O][C][=C][Ring1][#Branch2] |
CHEMBL4279670 | [O][C@H1][C@@H1][O][C@H1][O][C@H1][Branch2][Ring1][=Branch1][C][N][C][=C][Branch1][N][C][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=N][Ring1][=C][C@@H1][Branch2][P][C][O][C@H1][O][C@H1][Branch2][Ring1][=Branch1][C][N][C][=C][Branch1][N][C][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=N][Ring1][=C][C@@H1][Branch2][=C][=Branch2][O][C@H1][O][C@H1][Branch2][Ring1][=Branch1][C][N][C][=C][Branch1][N][C][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=N][Ring1][=C][C@@H1][Branch2][O][S][O][C@H1][O][C@H1][Branch2][Ring1][=Branch1][C][N][C][=C][Branch1][N][C][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=N][Ring1][=C][C@@H1][Branch2][=Branch2][#Branch1][O][C@H1][O][C@H1][Branch2][Ring1][=Branch1][C][N][C][=C][Branch1][N][C][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=N][Ring1][=C][C@@H1][Branch2][=Branch1][=C][O][C@H1][O][C@H1][Branch2][Ring1][=Branch1][C][N][C][=C][Branch1][N][C][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=N][Ring1][=C][C@@H1][Branch2][Ring2][Branch1][O][C@@H1][Branch2][Ring1][O][O][C@@H1][Ring2][=Branch2][=N][C][N][C][=C][Branch1][N][C][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=N][Ring1][=C][C@@H1][Ring2][#Branch2][=C][O][C@H1][Branch1][C][O][C@H1][Ring2][Ring2][O][O][C@H1][Branch1][C][O][C@H1][Ring2][=Branch1][Ring1][O][C@H1][Branch1][C][O][C@H1][Ring2][#Branch1][O][O][C@H1][Branch1][C][O][C@H1][Ring2][=Branch2][Ring1][O][C@H1][Branch1][C][O][C@H1][Ring2][#Branch2][O][O][C@H1][Branch1][C][O][C@H1][Ring2][N][Ring1][O] |
CHEMBL4279671 | [C][O][C][=C][C][=C][Branch2][Ring2][Ring2][C][N][C][=Branch1][C][=O][C][Branch1][C][O][C][=C][C][Branch1][=N][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][=C][C][=C][Ring1][=C][Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][#Branch2] |
CHEMBL4279672 | [O][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][=C][C][Branch2][Branch1][P][O][C][C][C][C][C][=C][N][Branch2][Ring2][P][C][C][O][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][#Branch1][=C][C][=C][Ring2][Branch1][N][Ring2][Branch1][C] |
CHEMBL4279757 | [O][C][=C][C][=C][Branch2][Ring1][P][C][=C][C][=C][Branch2][Ring1][=Branch1][C][=C][C][=C][Branch1][O][O][C][C][N][C][C][C][C][Ring1][Branch1][C][=C][Ring1][=C][Cl][Se][Ring2][Ring1][Ring2][C][Branch1][C][Cl][=C][Ring2][Ring1][O] |
CHEMBL4279758 | [C][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Branch2][Ring2][N][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=Branch2][Ring1][#Branch1][=C][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][NH1][C][Ring1][#Branch2][=C][Ring1][=C][Ring2][Ring1][Branch1][C][N][C][Ring1][S][=O][O][C@@H1][Branch1][C][C][C@@H1][Ring2][Ring1][S][O] |
CHEMBL4279759 | [N][=C][Branch1][C][N][N][C][C][C][C@H1][Branch2][=Branch2][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@@H1][C][C][C][N][Ring1][Branch1][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][=C][Branch2][Branch1][=Branch2][C][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][N][=N][Ring2][Ring2][=Branch2][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][Ring2][C][C][=C][C][=C][Branch1][C][O][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][#Branch2][C][Branch1][C][N][=O] |
CHEMBL4279760 | [C][O][C][=C][C][Branch1][C][N][=C][C][=C][Ring1][#Branch1][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C@H1][C][=C][C][=Branch1][S][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][C][N][Ring1][N][C][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][C][=C][Ring1][#Branch2][C@H1][Branch1][Branch1][C][Ring2][Ring2][Branch1][N][Branch1][C][C][C][C][Ring1][Branch2] |
CHEMBL4279761 | [O][=C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=S][N][C][C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][N][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2] |
CHEMBL4279762 | [C][C][=C][C][=C][C][Branch2][Ring1][S][C][N][Branch1][C][C][C][C][N][C][=N][C][Branch1][S][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C][=N][Ring1][=Branch2][=C][Ring1][=C][=C][Ring2][Ring1][=Branch2] |
CHEMBL4279763 | [C][C][=Branch1][C][=O][O][C@H1][C][=Branch1][C][=O][C@][C][C@H1][Ring1][Ring1][C][C@H1][O][C][C@@][Ring1][Ring2][Branch1][#Branch1][O][C][Branch1][C][C][=O][C@H1][Ring1][=N][C@H1][Branch2][Ring1][=Branch2][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][O][C@][Branch1][C][O][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][Branch1][C][C][=C][Ring2][Branch1][#Branch2][C][Ring2][Ring1][N][Branch1][C][C][C] |
CHEMBL4279860 | [O][=C][Branch1][C][O][C][=C][C][=C][Branch2][Ring1][C][C][=C][C][=C][Branch1][Branch2][N][C][=C][N][=C][Ring1][Branch1][C][=C][Ring1][O][C][=C][Ring1][P] |
CHEMBL4279861 | [N][C][=C][C][=C][Branch2][Ring2][=C][C][=C][C][=C][Branch2][Ring1][N][N][C][=C][C][=C][Branch1][=C][O][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][Branch1][C][Cl][=C][Ring1][S][N][=C][N][=C][Ring2][Ring1][#Branch1][S][Ring2][Ring1][#Branch2][C][=C][Ring2][Ring1][S] |
CHEMBL4279862 | [C][C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][=Branch2][C][Branch1][P][C][=C][Branch1][C][C][NH1][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][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] |
CHEMBL4279863 | [O][=C][Branch2][Ring1][Branch1][N][/N][=C][/C][=C][C][=C][N][Ring1][Branch1][C][C][C][N][C][C][C][C][Ring1][Branch1][N][C][=C][C][=C][Branch1][#C][O][C][=C][C][=N][C][NH1][C][=C][C][Ring1][=Branch2][=Ring1][Branch1][C][=C][Ring1][S] |
CHEMBL4279864 | [C][O][C][C][O][C][C][O][C][=Branch1][C][=O][C][C][C][C][C][C][C][O][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][#Branch2][C][=C][C][=C][Branch1][C][I][C][=Branch1][C][=O][C][Branch1][C][I][=C][Ring1][=Branch2][O][C][=C][Branch1][C][I][C][Branch1][C][O][=C][Branch1][C][I][C][=C][Ring2][Ring1][Ring2][Ring1][=Branch2] |
CHEMBL4279865 | [C][N][C][C][C][Branch2][Branch1][O][C][=N][C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=C][Branch2][Ring2][Ring1][C][=C][C][=N][C][Branch2][Ring1][#Branch1][N][C][=C][C][=C][Branch1][N][N][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][C][=C][Ring1][=N][=N][Ring2][Ring1][Ring2][S][Ring2][Ring1][S][C][C][Ring2][Ring2][=Branch1] |
CHEMBL4279866 | [N][C][C][=C][C][=C][Branch2][Ring1][=Branch2][C][=C][N][=C][C][Branch1][#C][O][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][=C][Ring1][S][S][Ring2][Ring1][Branch1] |
CHEMBL4279940 | [O][C][=C][C][=C][Branch2][Ring1][#C][C][=N][N][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][=Branch2] |
CHEMBL4279941 | [C][C][=C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Ring1][C][#N][=C][Ring1][Branch2][C][=N][C][=C][Ring1][P][C][Branch2][Ring1][=Branch1][C][C][C][N][Branch1][N][C][=Branch1][C][=O][C][C][C][O][C][Ring1][Branch1][C][C][Ring1][=N][=C][N][Ring2][Ring1][C][C] |
CHEMBL4279942 | [C][O][C][=C][C][=N][C][Branch1][=Branch2][N][C][C][C][C][C][Ring1][=Branch1][=N][C][Branch2][Ring1][Branch1][N][C][C][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=N][=C][Ring2][Ring1][#Branch2][C][=C][Ring2][Ring1][=C][O][C] |
CHEMBL4279943 | [C][O][C@@H1][C][C@H1][Branch2][Branch2][#Branch1][C][C@@H1][Branch1][C][C][C@@H1][C][C][=Branch1][C][=O][C@H1][Branch1][C][C][/C][=C][Branch1][C][\C][C@@H1][Branch1][C][O][C@@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C@H1][Branch1][C][C][/C][=C][/C][=C][/C][=C][Branch1][C][\C][C@H1][Branch1][Branch2][C][=C][C][=C][NH1][Ring1][Branch1][C][C@@H1][C][C][C@@H1][Branch1][C][C][C@@][Branch1][C][O][Branch1][Ring2][O][Ring1][Branch2][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][O][Ring2][Branch1][Branch2][C][C][C@H1][Ring2][Branch1][P][O] |
CHEMBL4279944 | [C][C][C][C][O][C][C][C][O][P][=Branch1][C][=O][Branch1][C][O-1][C][C][C][C][=Branch1][C][=O][N][Branch1][C][C][O].[Na+1] |
CHEMBL4280022 | [C][C][C][C][N][C][Branch2][Ring1][Ring2][C][=C][C][=C][C][Branch1][Ring1][O][C][=C][C][=C][Ring1][Branch2][NH1][C][Ring1][N][=O][P][=Branch1][C][=O][Branch1][Ring2][O][C][C][O][C][C] |
CHEMBL4280023 | [O][=C][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][S][Ring1][Branch2] |
CHEMBL4280024 | [C][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][=C][N][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][N][=C][Ring1][#Branch2][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][#Branch2] |
CHEMBL4280025 | [C][N][Branch2][Branch1][=Branch2][C][C][N][Branch1][C][C][C][C][=C][N][Branch2][Ring2][#Branch1][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][=N][C][C][=C][N][Branch2][Ring2][#Branch1][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][=N] |
CHEMBL4280026 | [O][=C][Branch1][O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][N][Branch1][=N][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Ring2][Ring1][=Branch2][=O] |
CHEMBL4280027 | [C][N][C][C][C][Branch2][Ring2][O][C][=N][C][Branch2][Ring1][Ring1][C][=C][C][=C][C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][=C][Ring1][#Branch2][=C][Branch1][N][C][=C][C][=N][C][Branch1][C][N][=N][Ring1][#Branch1][S][Ring2][Ring1][=Branch1][C][C][Ring2][Ring1][N] |
CHEMBL4280102 | [C][C][=C][C][=C][Branch2][Ring2][=N][O][C][=C][Branch2][Ring1][=N][/C][=N][\O][C][C][=C][Branch1][C][Cl][C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=N][N][Ring1][=N][C][C][Branch1][C][C][=N][N][Ring2][Ring1][Branch2][C][C][=C][Ring2][Ring1][S] |
CHEMBL4280103 | [C][C][C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][N][N][=C][N][=C][Branch2][Ring2][O][O][C][=C][C][=C][Branch2][Ring1][=N][N][C][=Branch1][C][=O][C][Branch1][P][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][Ring1][=N][C][=C][Ring2][Ring1][=Branch1][F][C][=Ring2][Ring2][=Branch2][Ring2][Ring1][=C] |
CHEMBL4280104 | [N-1][=N+1][=N][C][C][O][C][C][O][C][C][O][C][=C][C][=C][Branch2][Ring1][C][C][=C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][O][C][=C][Ring1][P] |
CHEMBL4280105 | [C][C][O][C][=N][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][C][Branch2][Ring1][Ring1][N][C][C][N][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][C][C][Ring1][N][C][=Branch1][C][=O][N][Branch2][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][O][C][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][Ring2][Ring2][Branch1] |
CHEMBL4280106 | [C][O][C][=C][C][Branch2][Ring2][Ring2][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][Branch1][=Branch1][C][Branch1][C][C][C][C][=C][Branch1][=Branch1][C][Branch1][C][C][C][C][=C][Ring1][N][C][Branch1][C][C][C][=C][C][=C][Ring2][Ring1][=Branch2][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C@H1][C][=C][C][=Branch1][S][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][C][N][Ring1][N][C][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][C][=C][Ring1][#Branch2][C@H1][Branch1][Branch1][C][Ring2][Ring2][Branch1][N][Branch1][C][C][C][C][Ring1][Branch2] |
CHEMBL4280107 | [C][#C][C][N][Branch1][Ring2][C][C][#C][C][C][#N] |
CHEMBL4280108 | [C][C][=C][C][Branch2][Ring1][S][C][=N][C][=C][C][C][Branch1][=N][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][=C][Branch1][C][N][O][C][Ring2][Ring1][C][=Ring1][=C][=C][C][=N][Ring2][Ring1][Branch2] |
CHEMBL4280109 | [N][C][C][C][C][C][C][C][C][=C][N][Branch2][P][=Branch1][C][C@H1][O][C@@H1][O][C@@H1][C@@H1][Branch2][Ring1][Ring1][C][N][C][=C][Branch1][=Branch2][C][C][C][C][C][C][C][N][N][=N][Ring1][=N][O][C@H1][Branch2][=C][N][O][C@@H1][C@@H1][Branch2][Ring1][Ring1][C][N][C][=C][Branch1][=Branch2][C][C][C][C][C][C][C][N][N][=N][Ring1][=N][O][C@H1][Branch2][N][=Branch1][O][C@@H1][C@@H1][Branch2][Ring1][Ring1][C][N][C][=C][Branch1][=Branch2][C][C][C][C][C][C][C][N][N][=N][Ring1][=N][O][C@H1][Branch2][=Branch2][S][O][C@@H1][C@@H1][Branch2][Ring1][Ring1][C][N][C][=C][Branch1][=Branch2][C][C][C][C][C][C][C][N][N][=N][Ring1][=N][O][C@H1][Branch2][#Branch1][#Branch2][O][C@@H1][C@@H1][Branch2][Ring1][Ring1][C][N][C][=C][Branch1][=Branch2][C][C][C][C][C][C][C][N][N][=N][Ring1][=N][O][C@H1][Branch2][Branch1][Ring2][O][C@@H1][C@@H1][Branch2][Ring1][Ring1][C][N][C][=C][Branch1][=Branch2][C][C][C][C][C][C][C][N][N][=N][Ring1][=N][O][C@H1][Branch1][#C][O][C@H1][Ring2][=Branch2][#Branch1][C@H1][Branch1][C][O][C@H1][Ring2][=Branch2][Branch2][O][C@H1][Branch1][C][O][C@H1][Ring2][Ring1][O][O][C@H1][Branch1][C][O][C@H1][Ring2][Branch1][C][O][C@H1][Branch1][C][O][C@H1][Ring2][=Branch1][=Branch2][O][C@H1][Branch1][C][O][C@H1][Ring2][#Branch1][S][O][C@H1][Branch1][C][O][C@H1][Ring2][=Branch2][#Branch1][O][C@H1][Branch1][C][O][C@H1][Ring2][#Branch2][=C][O][N][=N][Ring2][O][=Branch2] |
CHEMBL4280190 | [C][C][=C][C][=N][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][O][=C][C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][=C][Ring1][P][C][Branch1][C][C][=C][Ring2][Ring1][=Branch1][C][=C][C][=N][C][=C][Ring1][=Branch1] |
CHEMBL4280191 | [C][C][=N][C][Branch2][Ring1][=N][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][=C][C][Branch2][Ring1][=Branch1][N][C][C][C@H1][Branch1][=N][N][C][=Branch1][C][=O][C][C][C][C][O][Ring1][Branch1][C][Ring1][=N][=N][C][=N][N][Ring2][Ring2][=Branch1][Ring2][Ring1][Ring1] |
CHEMBL4280192 | [C][/C][=Branch1][Ring1][=N][/O][C][=C][C][=C][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][C][N][N][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][N][=C][Ring1][=Branch2][N][C][=C][Ring2][Ring1][Ring2] |
CHEMBL4280193 | [C][O][C][=C][C][=C][Branch2][Ring1][P][O][C][C][N][Branch2][Ring1][#Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][C][Ring1][S][C][=C][Ring2][Ring1][#Branch1] |
CHEMBL4280194 | [C][C][Branch1][C][O][Branch2][Ring1][Branch1][C][N][Branch1][=Branch2][C][Branch1][C][C][C][C][Ring1][Ring2][S][Branch1][C][C][=Branch1][C][=O][=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] |
CHEMBL4280278 | [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][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL4280279 | [N][#C][C][=C][C][Branch2][Ring1][Ring2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=C][N][Branch1][=C][/N][=C][/C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][Ring2][Ring1][O][=O] |
CHEMBL4280280 | [O][=C][C][S][C][=Branch1][C][=S][N][Ring1][=Branch1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2] |
CHEMBL4280281 | [C][C][Branch1][C][C][C][O][N][=C][Branch1][=N][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Cl][C][=Ring1][=N][C][O][C][=C][C][=C][C][=Branch1][C][=O][C][Branch2][Ring1][C][C][=C][C][=C][Branch1][Branch2][O][C][C][=Branch1][C][=O][O][C][=C][Ring1][O][=C][O][C][Ring2][Ring1][C][=C][Ring2][Ring1][=Branch1] |
CHEMBL4280282 | [C][O][C][=C][C][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][=C][C][=C][Ring2][Ring1][Ring1][C][C][=C][N][Branch1][C][C][C][=C][C][=C][Branch1][=C][N][C][=Branch1][C][=O][O][C][C][C][C][C][Ring1][Branch1][C][=C][Ring2][Ring1][Ring1][Ring1][#C] |
CHEMBL4280283 | [C][=C][C][=Branch1][C][=O][N][C][=C][C][Branch2][Ring1][P][C@H1][C][=Branch1][C][=C][C][=Branch1][C][=O][N][Ring1][=Branch1][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][N][=C][C][=C][Ring2][Ring1][Branch2][O][C] |
CHEMBL4280284 | [O][=C][Branch2][Branch1][Ring2][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][Branch1][S][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][=N][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][Ring2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][Branch1][C][Cl][S][Ring1][=Branch1] |
CHEMBL4280368 | [C][C][=Branch1][C][=O][N][C][C][C][=C][Branch1][C][O][C][=C][Branch2][Ring1][=Branch1][O][C][C][C][C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][=C][C][=C][Ring2][Ring1][=Branch1][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1] |
CHEMBL4280369 | [C][O][C@@H1][C][C@H1][Branch2][Branch2][C][C][C@@H1][Branch1][C][C][C@@H1][C][C][=Branch1][C][=O][C@H1][Branch1][C][C][/C][=C][Branch1][C][\C][C@@H1][Branch1][C][O][C@@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][C@H1][Branch1][C][C][C][C@H1][Branch1][C][C][/C][=C][/C][=C][/C][=C][Branch1][C][\C][C@@H1][Branch1][Ring1][S][C][C][C@@H1][C][C][C@@H1][Branch1][C][C][C@@][Branch1][C][O][Branch1][Ring2][O][Ring1][Branch2][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][O][Ring2][Branch1][Branch1][C][C][C@H1][Ring2][Branch1][=C][O] |
CHEMBL4280370 | [C][C][C][C][C][C][C][N][C][Branch2][Ring1][#Branch2][C][=C][C][Branch1][=N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][Cl][=N][C][Branch1][C][N][=N][Ring1][#C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][Branch2] |
CHEMBL4280371 | [N][#C][/C][=Branch1][S][=C][\C][=C][C][=C][C][=C][N][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][C][=C][NH1][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][N][Ring1][=Branch2] |
CHEMBL4280447 | [C][C][=C][Branch1][#Branch2][C][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Branch1][S][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][C][C][C][=C][Ring1][=Branch2][N][Ring2][Ring1][Branch1][C][C][C][C][=Branch1][C][=O][O] |
CHEMBL4280448 | [N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][P][N][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][N][=O][C][=C][Ring1][=Branch2][C][=C][Ring1][S] |
CHEMBL4280449 | [C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][Branch1][C][C][C][=C][C][Branch2][Ring1][Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][F][=C][C][=C][Ring2][Ring1][Branch1][Ring2][Ring1][N] |
CHEMBL4280450 | [O][=C][Branch2][Ring1][=Branch1][N][C][=N][C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=C][S][Ring1][N][C][=C][N][=C][C][Branch1][C][Cl][=N][Ring1][#Branch1] |
CHEMBL4280537 | [O][=C][Branch1][C][O][C][C][C][C][N][Branch2][Ring1][P][C][/C][=C][/C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][N] |
CHEMBL4280538 | [C][C][=N][N][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][/C][Ring1][=N][=C][/C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1] |
CHEMBL4280539 | [O][=P][Branch1][C][O][Branch1][C][O][C][Branch1][C][O][Branch2][Ring1][N][C][C][N][C][=N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][C][=C][C][=C][C][=C][Ring1][S][Ring1][=Branch1][P][=Branch1][C][=O][Branch1][C][O][O] |
CHEMBL4280540 | [C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch2][Ring2][Ring2][C][=C][C][=N][C][Branch2][Ring1][Branch2][N][C][=C][C][=C][C][Branch1][=N][O][C][C][C][C][C][C][=Branch1][C][=O][N][O][=C][Ring1][S][=N][Ring2][Ring1][#Branch1][C][=C][Ring2][Ring1][=N] |
CHEMBL4280622 | [C][C][N][C][=Branch1][C][=O][/C][=C][/C][=C][Branch1][S][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][S][Ring1][Branch1][C][=C][C][=Branch1][=Branch1][=C][Ring1][#C][O][C][O][C][O][Ring1][Branch2] |
CHEMBL4280623 | [C][O][C][=C][C][=C][C][Branch2][Branch1][Ring2][C][=N+1][C][=C][Ring1][=Branch1][C][=C][Branch1][P][C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][=C][C][=Branch1][S][=C][C][=Branch1][#Branch1][=C][Ring1][=Branch1][Ring2][Ring1][Ring2][C][C][Ring2][Ring1][#Branch1][O][C][O][Ring1][#Branch2][=C][Ring2][Ring1][P][O][C].[Br-1] |
CHEMBL4280624 | [O][=S][=Branch1][C][=O][Branch1][P][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][O][Ring1][#Branch1][N][C][C][C][C][=C][C@H1][C][C@H1][Branch1][N][C][N][C][C][C][C][C@H1][Ring1][#Branch2][Ring1][=Branch1][C@@H1][Ring1][=N][Ring1][P] |
CHEMBL4280625 | [C][O][C][=C][C][=C][Branch2][Ring2][=Branch1][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=C][Ring1][#C][C][=C][Ring2][Ring1][=N] |
CHEMBL4280626 | [C][C][C@H1][Branch1][C][C][C@@H1][C][=Branch1][C][=O][O][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][=O][N][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL4280627 | [C][C][C@H1][Branch1][C][C][C@H1][Branch2][Ring1][P][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][N][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][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][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1].[O][=C][Branch1][C][O][C][Branch1][C][F][Branch1][C][F][F] |
CHEMBL4280628 | [C][C@][C][C@@][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][C@@][Branch1][C][C][Branch2][Ring1][O][C][C][C][=Branch1][C][=O][N][C][=C][Branch1][C][O][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][Ring1][#Branch2][O][C@@H1][Ring2][Ring1][#C][C@H1][Branch1][#Branch2][C][C@H1][Ring2][Ring2][Ring2][C][Ring2][Ring2][Ring1][O][Ring2][Ring2][=Branch1] |
CHEMBL4280629 | [C][O][C][=C][C][=C][Branch2][Ring2][#C][/C][=C][/C][=Branch1][C][=O][O][C][C@H1][O][C@H1][C][=C][Branch1][#C][C][=C][Branch1][C][O][C][Branch1][Ring1][O][C][=C][Ring1][=Branch2][O][C][=Branch1][C][=O][O][C@@H1][Ring1][#C][C@@H1][Branch1][C][O][C@@H1][Ring2][Ring1][Ring2][O][C][=C][Ring2][Ring1][P] |
CHEMBL4280630 | [C][C][O][P][=Branch1][C][=O][Branch1][Ring2][O][C][C][C][Branch1][#Branch2][N][C][=N][C][=C][C][=N][Ring1][=Branch1][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1] |
CHEMBL4280631 | [C][O][C][O][C][=C][C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][C][=Branch1][C][=O][C][=C][Branch2][=Branch1][Branch1][C][=C][C][=C][Branch2][Branch1][=Branch2][O][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][Ring2][Ring2][#Branch2][O][C][Ring2][Ring2][P][=C][Ring2][Branch1][=N] |
CHEMBL4280632 | [C][C][C@H1][Branch1][C][C][C@H1][Branch3][Ring1][C][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][#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][=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][=Branch1][C][C][C][C][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@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@@H1][Branch2][#Branch2][S][N][C][=Branch1][C][=O][C@@H1][Branch2][#Branch2][C][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][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@H1][Branch1][Ring1][C][O][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][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][#C][C][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@H1][Branch2][#Branch1][O][C][=Branch1][C][=O][N][C@@H1][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][=Branch1][C][=O][N][C@H1][Branch2][Branch1][=C][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][N][C@H1][Branch2][Ring2][C][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O][C@@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][C][C][C@@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][C][C] |
CHEMBL4280704 | [O][=C][Branch1][S][C][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2][N][C][C][N][Branch1][P][C][=N][C][=N][C][NH1][C][=C][Branch1][C][Br][C][Ring1][#Branch2][=Ring1][=Branch1][C][C][Ring1][S] |
CHEMBL4280705 | [C][C@@H1][C][C][C@H1][C@@][Branch1][C][C][Branch1][C][O][C@@H1][Branch2][#Branch1][Ring1][O][C][C][N][C][C][N][Branch2][=Branch1][Ring2][C][=C][C][=C][Branch2][Ring2][Branch2][C][=Branch1][C][=O][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][O][N][C][C][C][C][O][C][C][Ring1][=Branch1][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][P][C][Branch1][#C][O][C][=C][N][=C][NH1][C][=C][C][Ring1][Branch1][=C][Ring1][=Branch2][=C][Ring2][Ring2][#Branch1][C][C][Ring2][Ring2][=N][O][C@@H1][O][C@@][Branch1][C][C][C][C][C@@H1][Ring2][Branch1][S][C@@][Ring2][Branch1][=C][Ring1][Branch2][O][O][Ring1][Branch2] |
CHEMBL4280706 | [C][C][S][C][Branch1][#Branch2][N][C][C][C][C][C][Ring1][=Branch1][=O][=C][C][=Ring1][N][C][=Branch1][C][=O][N][C][=N][C][=C][Branch1][Ring2][S][Ring1][Branch1][C][C][C][Ring1][=Branch1] |
CHEMBL4280707 | [C][C][C][C][C][C][=Branch1][C][=O][N][C@H1][C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C@@H1][Branch1][=Branch2][O][C][Branch1][Ring1][C][C][C][C][C@@H1][Ring1][#C][N][C][Branch1][C][C][=O] |
CHEMBL4280708 | [C][C][C][C][C][C][C][C][C][C][C][C][O][C][Branch1][=Branch2][C][N][C][=N][C][=N][Ring1][Branch1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F] |
CHEMBL4280709 | [C][=C][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch2][Ring2][=N][N][C][=N][C][Branch2][Ring1][#C][N][C][=C][C][=C][Branch1][#C][O][C][C][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][C][=N][C][=C][Ring2][Ring1][=Branch2][F][=C][Ring2][Ring1][P] |
CHEMBL4280789 | [N][C][=C][C][=C][C][=Branch1][Branch1][=C][Ring1][=Branch1][O][O][C][=C][C][=C][Branch1][Branch1][C][=C][Ring1][=Branch1][C][C][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1][C][=C][C][=C][Branch1][=Branch1][C][=C][Ring1][=Branch1][O][C][C][Ring2][Ring1][=C] |
CHEMBL4280790 | [C][O][C][=C][C][=C][Branch2][=Branch1][S][N][C][=Branch1][C][=O][C][Branch2][Branch1][O][C][=Branch1][C][=O][N][C][=C][C][=C][Branch2][Ring2][#Branch1][O][C][=C][C][=N][C][=C][C][Branch1][S][O][C][C][C][N][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][=C][Branch1][Ring1][O][C][C][=C][Ring2][Ring1][#Branch1][Ring2][Ring1][Ring1][C][Branch1][C][F][=C][Ring2][Ring1][#C][=C][C][=C][C][=C][N][=C][Ring1][=Branch1][Ring2][Ring2][=N][C][=C][Ring2][Branch1][Ring1] |
CHEMBL4280791 | [C][N][C][=Branch1][C][=S][N][C][C][Branch1][C][C][C][C][C][=C][C][=C][C][=C][C][Branch1][Ring1][O][C][=C][C][Ring1][Branch2][=C][Ring1][N][Ring1][S] |
CHEMBL4280792 | [C][C][=C][C][=C][Branch2][Ring2][=C][C][=C][N][Branch2][Ring2][Ring1][C][C][=Branch1][C][=O][N][C@@H1][C@@H1][Branch1][C][O][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][O][C@H1][Ring1][#Branch2][C@H1][Branch1][C][O][C@H1][Branch1][C][O][C][O][N][=N][Ring2][Ring1][=Branch2][C][=C][Ring2][Ring1][#C] |
CHEMBL4280867 | [C][C][C][N][C][=N][C][Branch1][Branch1][S][C][C][C][=N][C][=C][Ring1][#Branch2][N][=C][C][=Branch1][C][=O][N][Ring1][#Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL4280868 | [C][C][=C][C][Branch1][C][O][=C][Branch2][Ring1][C][C][=Branch1][C][=O][/C][=C][/C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][O][Ring2][Ring1][Ring1] |
CHEMBL4280869 | [C][O][C][=C][C][=C][C][Branch2][Ring1][=C][C][=C][C][=C][Branch2][Ring1][Ring1][N][C][=C][C][=Branch1][C][=O][N][Branch1][C][O][C][=Branch1][C][=O][NH1][Ring1][=Branch2][C][=C][Ring1][S][=C][Ring2][Ring1][=Branch1] |
CHEMBL4280870 | [O][C][=C][C][=C][Branch2][Ring1][C][C][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][NH1][Ring1][O][C][=C][Ring1][P] |
CHEMBL4280871 | [C][Se][C][=C][C][=C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][=C][C][=N][Se][N][=C][Ring1][Branch1][C][=Ring1][=Branch2][C][=C][Ring2][Ring1][C] |
CHEMBL4280872 | [C][C@H1][O][C@@H1][C][C@][Branch1][C][O][Branch1][Branch1][C@H1][Ring1][#Branch1][O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=Branch2][Ring1][#Branch2][=C][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][N][Ring2][Ring1][=Branch2][C][Ring1][#Branch2][=C][Ring1][=C][Ring2][Ring1][Branch1][C][=Branch1][C][=O][N][C][Ring1][P] |
CHEMBL4280873 | [C][C][C][C][=Branch1][C][=O][N][C][C][C][C][=C][C][Branch2][Ring1][#C][C][C][C][C][N][C][C][C][Branch1][P][C][=N][O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch2][Ring1][#Branch1][C][C][Ring1][S][=C][C][Ring2][Ring1][P][=C][Ring2][Ring1][#Branch2][Ring2][Ring1][=C] |
CHEMBL4280957 | [C][N][Branch1][C][C][C@@H1][C][=Branch1][C][=O][C][Branch1][=Branch1][C][Branch1][C][N][=O][=C][Branch1][C][O][C@@][Branch1][C][O][C][=Branch1][C][=O][C][=C][Branch1][C][O][C][=C][Branch1][C][O][C][=C][C][=C][Ring1][#Branch1][C@@][Branch1][C][C][Branch1][C][O][C@H1][Ring1][=C][C@H1][Branch1][C][O][C@@H1][Ring2][Ring1][=C][Ring2][Ring1][Branch1] |
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