chembl_id stringlengths 7 13 | selfies stringlengths 3 6.7k |
|---|---|
CHEMBL4293651 | [C][C][C][C][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][N][C][=Branch1][C][=O][C][C][C] |
CHEMBL4293652 | [C][C@@H1][Branch2][Ring2][O][N][C][=N][C][Branch1][O][N][C@H1][Branch1][C][C][C][C][C][Ring1][Ring1][=N][C][Branch2][Ring1][C][N][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][Ring1][=Branch2][=N][Ring2][Ring1][Branch1][C][C][C][Ring1][Ring1] |
CHEMBL4293653 | [C][O][C][C][C][C][C][N][=C][Branch1][#Branch2][N][C][=C][C][=C][N][=C][Ring1][=Branch1][S][C][=Ring1][N][Ring1][S] |
CHEMBL4293742 | [C][C][C][Branch1][C][C][C][=N][C@@H1][Branch2][Ring2][Ring1][C][C][C][C][N][C][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][N][Branch1][=N][C][C][C][C][C][Branch1][C][C][C][C][Ring1][#Branch1][C][Ring1][P][=S][C][N][Ring2][Ring1][O] |
CHEMBL4293743 | [F][C][=C][C][=C][Branch2][Ring1][Ring1][C][=N][C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][F][=N][O][Ring1][N][C][=C][Ring2][Ring1][C][F] |
CHEMBL4293744 | [C][O][C][=C][C][=C][Branch1][O][C][Branch1][Ring1][O][C][=C][Ring1][Branch2][O][C][C][=C][C][=C][Branch1][#Branch1][S][C][Branch1][C][C][C][C][=Branch1][C][=O][C][=C][Ring1][N][C@@H1][Branch1][C][N][C][C][Ring2][Ring1][Branch2] |
CHEMBL4293745 | [C][C][C][=C][Branch2][Branch1][=Branch1][C][N][C][=Branch1][C][=O][N][Branch1][N][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][P][S][=Branch1][C][=O][=Branch1][C][=O][N][C][Branch1][C][C][C][C][Ring1][Ring2][=C][C][=C][Ring1][=C][Ring2][Ring1][O][N][Branch1][C][C][N][=Ring2][Ring2][C] |
CHEMBL4293830 | [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][C][Ring2][Ring1][C] |
CHEMBL4293831 | [C][C][/C][=Branch2][Ring1][=C][=C][Branch1][=Branch2][\C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=N][N][Branch1][#Branch2][O][C][C][C][N][Branch1][C][C][C][C][=Ring1][N][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL4293832 | [C][C][C][Branch1][Ring1][C][C][O][C@@H1][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C@H1][Branch2][Ring1][Ring2][N][C][C][=C][C][=C][Branch1][Branch2][S][C][C][Branch1][C][C][C][C][=C][Ring1][O][C@H1][Ring2][Ring1][=Branch1][N][C][Branch1][C][C][=O] |
CHEMBL4293833 | [O][=C][Branch2][Ring1][Branch2][C][C][N][C][C][N][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][C][Ring1][=N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][=Branch1][C][=O][N][Ring1][Branch2][C][C][C][Ring1][N] |
CHEMBL4293834 | [C][O][C][=C][C][Branch2][Ring2][P][C][=Branch1][C][=O][N][C][=Branch1][C][=N][N][C][=C][C][=C][Branch1][C][C][C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][N][=C][Ring2][Ring1][=Branch1][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring2][Ring2][O][C].[Cl] |
CHEMBL4288863 | [C][C][C][C][C][Branch2][Ring1][Branch2][O][C][=N][C][=C][Branch1][=N][C][=C][C][=C][Branch1][Ring1][C][C][C][=C][Ring1][Branch2][C][=N][Ring1][=C][C][=C][C][=C][Branch1][=N][C][=Branch1][C][=O][N][C][C][C][=Branch1][C][=O][O][C][=C][Ring1][=C] |
CHEMBL4288864 | [C][O][C][=C][C][=C][Branch2][Ring1][=N][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][C][C][C@H1][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][C][Branch1][Ring1][C][#N][=C][C@][Ring2][Ring1][#C][Ring1][O][C] |
CHEMBL4288865 | [C][C][Branch1][C][C][N][C][C][C][Branch2][Ring2][Branch2][N][C][C][C][N][Branch2][Ring1][O][C][=C][C][=C][C][Branch1][P][C][=C][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][NH1][Ring1][#Branch2][=C][Ring1][S][C][C][Ring2][Ring1][=Branch1][C][C][Ring2][Ring1][=N] |
CHEMBL4288866 | [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][C][C][=C][Ring1][#Branch1][N][=N][Ring1][N][=C][\C][C][C@@][Branch1][C][C][O][C@@H1][Ring2][Ring1][=Branch2][Ring1][Ring2] |
CHEMBL4288960 | [C][C][=C][C][Branch2][Ring1][Branch2][O][C][C][C][C][N][C][C][N][Branch1][=Branch2][C][=C][N][=C][C][=N][Ring1][=Branch1][C][C][Ring1][N][=C][C][Branch1][C][C][=C][C][=Branch1][C][=O][O][C][Ring1][Branch2][=C][Ring2][Ring1][=N] |
CHEMBL4288961 | [C][O][C][=Branch1][C][=O][C@][C][C][C][Branch1][C][C][Branch1][C][C][C][C@@H1][Ring1][Branch2][C][/C][=Branch1][Ring1][=N][/O][C][C@@H1][C@@][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C@@H1][Ring1][O][C][C][C@@][Ring1][#C][Branch1][C][C][C@][Ring2][Ring1][=Branch1][Branch1][C][C][C][C][Ring2][Ring1][P] |
CHEMBL4288962 | [C][O][C][=C][C][=C][N][=C][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][C][C][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][=Branch2][S][C][Ring1][P][=C][Ring2][Ring1][Branch1] |
CHEMBL4288963 | [C][O][C][=C][C][=C][Branch2][Ring1][Branch1][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][Ring2] |
CHEMBL4288964 | [C][C][C][C][C][=N][C][Branch1][=Branch1][C][Branch1][C][C][C][=C][Branch1][=N][C][C][=Branch1][C][=S][N][C][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][N][Ring2][Ring1][C][C][C][=C][C][=C][Branch2][Ring1][Ring1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=N][O][C][=Branch1][C][=O][NH1][Ring1][=Branch1][C][=C][Ring2][Ring1][C] |
CHEMBL4288965 | [C][O][C][C][C][C][C][N][=C][Branch2][Ring1][=Branch1][N][C][=C][C][=C][Branch1][O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][Ring1][=C][S][C][=Ring2][Ring1][Ring2][Ring2][Ring1][Branch2] |
CHEMBL4288966 | [C][C][C][C][C][C][=C][C][=C][Branch2][Branch1][=N][C][=C][C@][C][C@@H1][C][C@H1][Branch1][O][O][C@@][Ring1][Branch1][Branch1][C][C][C][Ring1][=Branch2][C@H1][Ring1][#Branch2][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][Ring2][Ring1][#C][=O][C][=C][Ring2][Ring2][=Branch1] |
CHEMBL4289047 | [C][N][Branch2][Ring1][#Branch1][C][/C][=C][/C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][F][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][O][Ring1][#Branch1].[Cl] |
CHEMBL4289048 | [O][=C][Branch1][C][O][C][=C][C][=C][Branch2][Ring2][N][N][Branch1][S][C][C][=C][N][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][N][C][=C][Ring2][Ring1][P] |
CHEMBL4289049 | [C][C][=C][N][=C][Branch2][Ring1][=C][C][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][O][Ring1][Branch2][C][Ring1][#C][N][Ring2][Ring1][Branch1][C][C][C][C][Ring1][Ring1] |
CHEMBL4289050 | [C][C][C][C][O][C][=N][C][=C][Branch1][P][C][=Branch1][C][=O][N][Branch1][C][C][C][=Branch1][C][=O][N][Ring1][=Branch2][C][N][Ring1][=N][C][C][C][C][=Branch1][C][=O][N][C][=C][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][Ring1][#Branch2][O] |
CHEMBL4289051 | [C][C][C][C][C@@H1][Branch2][Ring1][=C][S][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][O][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][C@][Branch1][Branch2][C][C][C][N][C][Ring1][=Branch1][C][Ring1][O] |
CHEMBL4289052 | [C][O][C][=C][C][=C][Branch2][Ring2][=N][O][C][=C][C][=C][Branch2][Ring1][#C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][N][=C][Ring1][=Branch1][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][S][=O][C][=C][Ring2][Ring1][#Branch2][F][C][=C][N][=C][Ring2][Ring2][C][C][=C][Ring2][Ring2][=Branch1][O][C][C][C][N][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1] |
CHEMBL4289126 | [C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][Branch2][Ring1][=C][C][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][N][Ring1][O][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][=C][N][Ring2][Ring1][=Branch2][C] |
CHEMBL4289127 | [F][C][=C][Branch2][Ring1][=N][C][N][C][=N][C][Branch2][Ring1][C][C][=C][C][Branch1][Branch2][C][=C][NH1][N][=N][Ring1][Branch1][=C][C][=N][Ring1][O][=C][Ring1][S][C][=C][C][=C][Ring2][Ring1][#Branch1][O][C][Branch1][C][F][Branch1][C][F][F] |
CHEMBL4289128 | [C][O][C][=C][C][=C][Branch2][Branch1][#Branch1][C][=Branch1][C][=O][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][C][=C][Ring2][Ring2][Branch1] |
CHEMBL4289129 | [C][C][=C][C][=C][Branch2][Ring1][P][C][=C][S][C][Branch2][Ring1][=Branch1][N][/N][=C][/C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][=N][Ring2][Ring1][C][C][=C][Ring2][Ring1][Branch2] |
CHEMBL4289130 | [O][C][C][=C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][=Ring1][P][C][Branch1][=C][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][=N][Ring2][Ring1][=C] |
CHEMBL4289205 | [C][C][O][N][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][O][C][=C][C][=N][C][Branch2][Ring1][Ring1][N][C][C][C][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][=N][Ring2][Ring1][C] |
CHEMBL4289206 | [C][O][C][=C][C][=C][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][C][=C][N][Branch1][#Branch2][C][C][C][C][O][C][C][Ring1][=Branch1][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][Branch2][Ring1][=C][C][=C][Ring2][Ring1][S] |
CHEMBL4289207 | [C][C][C][C][C][C][C][C][C][C][C][C][C][N][C][C][=Branch1][C][=O][N][Branch1][=Branch1][C][C][C][C][N][C][C][=Branch1][C][=O][N][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][C][=C][C][=N][C][=C][Ring1][=Branch1] |
CHEMBL4289208 | [C][O][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][=O][=Branch1][C][=O][C][Ring2][Ring1][#Branch2] |
CHEMBL4289209 | [O][C][C][=C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch2][Ring1][Ring2][C][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][C][=Ring2][Ring1][Ring2][C][Branch1][=C][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][=N][Ring2][Ring1][P] |
CHEMBL4228781 | [O][=C][Branch1][C][O][C][=C][C][=N][C][Branch2][Ring1][Branch1][N][N][=C][C][=C][Ring1][Branch1][O][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][=C][Ring2][Ring1][Ring2] |
CHEMBL4228782 | [C][C][=C][C][Branch1][Branch1][/C][=C][/C][#N][=C][C][Branch1][C][C][=C][Ring1][O][O][C][=C][C][Branch1][#Branch2][N][C][C][C][C][C][O][Ring1][Branch1][=N][C][Branch1][=C][N][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][=C][Ring2][Ring1][=Branch1] |
CHEMBL4228783 | [C][C][Branch1][C][C][C@@H1][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@@H1][C][S][S][C][C@H1][Branch1][Branch2][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][N][C@@H1][Branch2][#Branch1][#Branch1][C][S][S][C][C@@H1][Branch1][=Branch1][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][Branch1][=Branch2][C][C][=N][C][=C][NH1][Ring1][Branch1][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O][N][C][Ring2][=Branch1][=N][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C@@H1][Branch1][=Branch2][C][C][=N][C][=C][NH1][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C@H1][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][Ring2][Branch2][Ring1] |
CHEMBL4228784 | [C][C][C][C][N][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][C][C][C][N][Branch1][Ring2][C][C][C][C][C][Ring1][=Branch2] |
CHEMBL4228785 | [C][O][C][=Branch1][C][=O][/C][=C][Branch1][C][/C][N][/C][=C][/C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring1][P][N][C][=Branch1][C][=S][N][C][=C][C][=C][Branch1][P][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][C][=C][C][=N][Ring1][=Branch1][C][=C][Ring1][S][=C][Ring2][Ring1][#Branch2] |
CHEMBL4228786 | [C][S][C][=C][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][S][Ring1][Branch1][C][Branch1][C][N][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring2][Ring1][C][C][#N] |
CHEMBL4228787 | [C][O][C][=C][C][Branch1][Ring1][C][#N][=C][C][Branch2][Branch1][Ring1][C][C][Branch1][C][C][=N][N][Branch2][Ring1][S][C][=N][C][Branch1][#C][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2][=C][Branch1][#Branch1][S][C][Branch1][C][C][C][S][Ring1][P][C][=Ring2][Ring1][#Branch1][C][=Branch1][C][=O][O][=C][Ring2][Ring2][C] |
CHEMBL4228788 | [C][O][C][=Branch1][C][=O][N][C][=C][C][=C][Branch2][Branch1][N][C][=C][C][Branch2][Ring2][=N][C@H1][Branch1][P][C][C][=Branch1][C][=O][N][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][N][C][=Branch1][C][=O][/C][=C][/C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][N][C][=N][N][=N][Ring1][Branch1][=C][Branch1][C][Cl][N][=N][Ring2][Ring2][Ring1][C][=C][Ring2][Ring2][=Branch2] |
CHEMBL4228872 | [C][C][=C][C][=C][C][=Branch1][C][=O][N][Ring1][#Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Ring1][#Branch2][Branch1][C][C][C] |
CHEMBL4228873 | [C][/C][=C][\C][=C][Branch1][#Branch2][C][C@H1][Branch1][C][C][C][Ring1][=Branch1][=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][C][C][C@@H1][C@H1][Branch1][#Branch1][C][C@H1][Ring2][Ring1][=N][O][C@@][Ring1][=Branch1][Branch1][C][C][C][O] |
CHEMBL4228874 | [N][C][C][C][N][C][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2] |
CHEMBL4228875 | [C][=C][C][=Branch1][C][=O][N][C][C][C][C][C@H1][Branch1][#C][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][N][Branch1][S][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][N][=C][Ring1][=Branch2][C][C][Ring1][#C] |
CHEMBL4228876 | [C][C][=C][Branch1][C][C][C][=Branch1][C][=O][C][Branch2][Ring1][S][C][C][C@@][Branch1][C][C][Branch1][C][O][C][C][C][C@@H1][Branch1][C][C][C][C][C][C@@H1][Branch1][C][C][C][C][C][C][Branch1][C][C][C][=C][Branch1][C][C][C][Ring2][Ring1][=C][=O] |
CHEMBL4228877 | [C][=C][C][=Branch1][C][=O][N][C][=C][C][Branch2][Ring1][N][N][C][=N][C][=C][N][=C][N][Branch1][N][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][Ring1][N][=N][Ring1][S][=C][Branch1][Ring1][O][C][C][=C][Ring2][Ring1][=Branch2][N][Branch1][C][C][C][C][N][Branch1][C][C][C] |
CHEMBL4228878 | [O][C][C@H1][O][C@@H1][Branch2][Ring2][Ring1][C][=C][C][Branch1][S][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][Ring1][Branch1][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][=C][Ring2][Ring1][C][O][C@H1][Branch1][C][O][C@@H1][Branch1][C][O][C@@H1][Ring2][Ring1][O][O] |
CHEMBL4228962 | [C][C][=N][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][N][Ring1][Branch2][C][C][C][C][C][Br] |
CHEMBL4228963 | [C][C][N][=C][S][C][=Ring1][Branch1][C][=C][C][=C][Branch2][Ring2][=N][C][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Branch1][C][O][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@@H1][Branch1][=C][N][C][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring2][Ring1][=C] |
CHEMBL4228964 | [C][C][C][C][C][C][C][C][/C][=C][\C][C][C][C][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][O] |
CHEMBL4228965 | [C][=C][C][=Branch1][C][=O][C@][C][C@@][Ring1][=Branch1][Branch1][C][O][C][C][C@H1][Ring1][#Branch1][C][=C][C][=C][Branch1][C][O][C][Branch1][C][C][=C][Ring1][Branch2][C@@H1][Ring1][S][C][N][C][=C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][N][=N][Ring1][#C] |
CHEMBL4228966 | [C][N][Branch2][Ring1][C][C][C][=N][N][=C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][O][Ring1][#Branch2][C][C][C][C][C][C][C][Ring1][=Branch1] |
CHEMBL4228967 | [C][C][=C][C][Branch2][=Branch1][#C][C][=Branch1][C][=O][N][C@H1][C][C][C][C][C][/C][=C][\C@@H1][C][C@@][Ring1][Ring1][Branch2][Ring1][C][C][=Branch1][C][=O][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][Ring1][Ring1][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Branch2][Ring1][Ring2][O][C][=N][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][N][=C][Ring1][O][C][C][N][Ring2][Ring1][C][C][Ring2][Ring2][#Branch2][=O][=N][O][Ring2][Branch1][Ring1] |
CHEMBL4228968 | [O][=S][=Branch1][C][=O][Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][F][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2] |
CHEMBL4229044 | [O-1][C][O][N][=S+1][C][=Ring1][Branch1][C][=C][C][Branch1][C][F][=C][C][Branch1][C][F][=C][Ring1][Branch2] |
CHEMBL4229045 | [O][=C][C][Branch1][Branch2][C][C][=C][NH1][N][=Ring1][Branch1][=N][NH1][C][=C][Branch1][#C][C][=C][C][=C][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][C][=N][N][Ring2][Ring1][Branch2][Ring1][#C] |
CHEMBL4229046 | [C][C][=C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][=C][C][=C][NH1][N][=C][C][Ring1][Branch1][=C][Ring1][=Branch2][C][Branch2][Ring2][Branch1][C][=C][C][=C][Branch1][C][F][C][Branch2][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C][C][C][C][C][Branch1][Ring2][C][Ring1][Branch2][N][Ring1][=Branch1][C][=C][Ring2][Ring1][Ring2][N][C][=Branch1][C][=O][N][Ring2][Ring2][#Branch1] |
CHEMBL4229047 | [C][C][C@H1][Branch1][C][C][C@H1][Branch3][Ring1][Ring1][=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][Branch2][C][C][C][=Branch1][C][=O][O][N][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][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][Branch2][C][C][C][Branch1][C][N][=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@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][Ring1][C][O][N][C][=Branch1][C][=O][C@H1][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C@@H1][Branch2][=Branch2][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][Branch2][=Branch1][N][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C@@H1][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][=Branch1][C][=O][N][C@@H1][Branch1][C][C][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][#Branch2][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][#Branch2][C][C][C][N][C][=Branch1][C][=N][N][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][Branch2][C][S][C][C][C][C][=Branch1][C][=O][N][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][Ring1][O][=O][C][Branch1][C][N][=O][C][Branch1][C][C][C] |
CHEMBL4229048 | [O-1][C][O][N][=S+1][C][=Ring1][Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL4229049 | [C][=C][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch2][Branch1][Branch2][N][C][=Branch1][C][=O][C][Branch2][Ring2][#Branch2][C][=Branch1][C][=O][N][C][=C][C][=N][C][Branch2][Ring1][=Branch2][N][C][=C][C][=C][Branch1][N][N][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][C][=C][Ring1][=N][O][C][=N][Ring2][Ring1][=Branch1][C][C][Ring2][Ring1][N][=C][Ring2][Ring2][Branch1] |
CHEMBL4229050 | [Cl][C][=C][C][=C][Branch2][Branch1][C][N][C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][=N][C][=C][Branch2][Ring1][Branch1][N][C][C][N][Branch1][O][C][C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][C][Ring1][=C][N][=C][N][=C][Ring2][Ring1][Ring2][Ring2][Ring1][=C][C][=C][Ring2][Ring2][Ring2] |
CHEMBL4229051 | [C][C@@H1][C@H1][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][C@@][Ring2][Ring1][Branch2][Branch2][Ring1][O][C][=Branch1][C][=O][O][C][C][=N][N][=C][Branch1][N][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][O][Ring1][N][C][C][C@H1][Ring2][Ring2][N][C] |
CHEMBL4229052 | [C][=C][C@@H1][C][C@][Ring1][Ring1][Branch2][=Branch1][Branch2][N][C][=Branch1][C][=O][C@@H1][C][C@@H1][Branch2][Ring1][Ring2][O][C][=N][C][=C][C][=C][C][Branch1][Ring1][O][C][=C][C][=C][Ring1][N][Ring1][Branch2][C][N][Ring2][Ring1][C][C][=Branch1][C][=O][C@@H1][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][N][C@H1][Branch1][#Branch1][C][=Branch1][C][=O][O][C][C][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][Ring1][Ring1] |
CHEMBL4229053 | [Cl][C][=C][C][=C][Branch2][Ring2][#Branch2][C][=C][N][=C][Branch2][Ring1][#C][N][C][C][C][C][C][C][C][C][N][C][=N][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][NH1][Ring1][N][NH1][Ring2][Ring1][O][C][=C][Ring2][Ring1][P] |
CHEMBL4229141 | [C][C][Branch1][C][C][C][=C][C][=C][Branch2][Ring1][=Branch1][C][=C][C][Branch1][=Branch1][C][=Branch1][C][=O][O][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][=N][C][=C][Ring2][Ring1][Ring1] |
CHEMBL4229142 | [O][=C][Branch2][Ring1][Ring1][/C][=C][/C][=C][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][N][O][C][=C][Ring1][#Branch2][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][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1] |
CHEMBL4229143 | [C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][=C][N][=C][Branch1][=Branch1][C][Branch1][C][F][F][C][Branch1][O][C][=Branch1][C][=O][N][C][=Branch1][C][=N][N][=C][Ring1][#C] |
CHEMBL4229144 | [C][C][=C][C][=C][C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][N][C][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][=N][=C][Ring2][Ring1][#Branch1] |
CHEMBL4229145 | [C][=Branch2][Ring1][Branch2][=C][/C][=N][N][C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][=N][N][=C][Ring1][O][S][Ring1][=C][\C][=C][C][=C][O][Ring1][Branch1] |
CHEMBL4229227 | [C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][Branch2][Ring1][O][C][N][C][=C][Branch1][P][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][F][Branch1][C][F][F][N][=N][Ring1][#C][=N][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][Ring2][Ring1][O][=O] |
CHEMBL4229228 | [C][=C][C][=Branch1][C][=O][C@][C][C@@][Ring1][=Branch1][Branch1][C][O][C][C][C@H1][Ring1][#Branch1][C][=C][C][=C][Branch1][C][O][C][Branch1][C][C][=C][Ring1][Branch2][C@@H1][Ring1][S][C][N][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][=N][Ring1][N] |
CHEMBL4229229 | [C][=C][C][=C][Branch1][C][C][C][=C][C][=N][C][=Branch2][Ring2][#C][=C][C][NH1][C][Branch2][Ring1][Branch2][C][=C][N][=C][Branch1][=Branch2][C][=C][Ring2][Ring1][C][NH1][Ring1][S][C][Branch1][C][C][=C][Ring1][=Branch2][C][C][=C][Branch1][C][C][C][=Ring2][Ring1][C][C][=Branch1][C][=O][C][Ring2][Ring1][=Branch1][C@@H1][Branch2][#C][O][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][=N][Ring1][C][=Branch1][C][=O][N][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][C][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][#C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C@@H1][Branch2][=Branch1][N][C][C][C][C][N][C][=Branch1][C][=O][C][C][C][C][C][O][C][=C][Branch2][Ring2][=Branch1][/N][=N][/C][=C][C][Branch1][Ring1][O][C][=C][Branch2][Ring1][C][/N][=N][/C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][=C][Ring2][Ring1][Ring1][O][C][C][=C][C][=C][Ring2][Ring1][=N][C][C][C][N][Ring1][=Branch1][C][C][C][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][O][C@@H1][Branch1][C][C][O][C@@H1][Branch1][C][C][C][C][C@@H1][Ring2][N][C][C] |
CHEMBL4229230 | [O][=C][Branch2][Ring1][=Branch2][N][C][=N][C][=C][Branch1][#C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][Ring1][Branch1][S][Ring1][#C][C][C][C][C][C][C][Ring1][=Branch1] |
CHEMBL4229231 | [O][=C][Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2] |
CHEMBL4229232 | [N][#C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][C][=C][N][=C][Ring1][=N][Ring1][=Branch1] |
CHEMBL4289320 | [C][C][Branch1][C][C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C@@H1][C][C][=C][Branch1][S][C][=C][C][C][=C][C][=Branch1][C][=O][O][C][Ring1][O][=Ring1][#Branch1][O][Ring1][=C] |
CHEMBL4289321 | [C][C][=C][C][=N][C][Branch1][=Branch2][C][=Branch1][C][=O][N][C][C][O][=C][C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][=C][Ring2][Ring1][Ring1][C][Branch1][C][C][=C][Ring2][Ring1][Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1] |
CHEMBL4289322 | [N][C][=C][C][Branch2][Ring1][Ring1][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][=C][Branch1][P][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][Cl][S][Ring2][Ring1][=Branch2] |
CHEMBL4289323 | [C][C][C@H1][O][C][=Branch1][C][=O][C@H1][Branch1][C][C][C@@H1][Branch1][C][O][C@H1][Branch1][C][C][C@@H1][Branch2][Ring1][Branch1][O][C@@H1][O][C@H1][Branch1][C][C][C][C@H1][Branch1][=Branch1][N][Branch1][C][C][C][C@H1][Ring1][#Branch2][O][C@][Branch1][C][C][Branch1][Ring1][O][C][C][C@@H1][Branch1][C][C][/C][=Branch1][=N][=N][/O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C@H1][Branch1][C][C][C@@H1][Branch1][C][O][C@][Ring2][Ring2][=C][Branch1][C][C][O] |
CHEMBL4289324 | [O][=S][=Branch1][C][=O][Branch1][N][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][N][Branch1][=Branch2][C][C][=C][C][=C][S][Ring1][Branch1][C][C][=C][C][=C][S][Ring1][Branch1] |
CHEMBL4289404 | [C][C][=C][N][=C][Branch1][Branch2][C][C][C][C][O][Ring1][Branch1][N][Ring1][#Branch2][C][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][O][Ring1][Branch2][C][C][Ring1][S] |
CHEMBL4289405 | [O][=C][Branch2][Ring1][O][N][C][C][=C][C][=C][C][Branch1][#C][C][=C][N][C][=Branch1][Ring2][=N][Ring1][Branch1][C][C][C][Ring1][=Branch1][=C][Ring1][=C][C][C][C][C][C][C][Ring1][=Branch1] |
CHEMBL4289406 | [C][O][C][=C][C][=N][C][Branch1][N][N][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][=N][C][Branch1][#Branch2][N][C][C][C][C][C][C][Ring1][=Branch1][=C][Ring2][Ring1][Ring2][C][=C][Ring2][Ring1][Branch2][O][C] |
CHEMBL4289407 | [C][N][C][=Branch1][C][=O][N][Branch1][=Branch2][C][C][C][=C][O][C][=Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][P][S][=Branch1][C][=O][=Branch1][C][=O][N][C][Branch1][C][C][C][C][Ring1][Ring2][=C][C][=C][Ring1][=C][Ring2][Ring1][#Branch2] |
CHEMBL4289487 | [C][C][=C][C][=C][C][Branch2][Ring1][S][C][=N][N][C][=Branch1][N][=C][Ring1][Branch1][C][=C][C][=N][C][=C][Ring1][=Branch1][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][#C][=C][Ring2][Ring1][#Branch1][C][#N] |
CHEMBL4289488 | [C][O][C][=C][C][=C][Branch2][Ring1][Branch2][N][C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][=N][N][=C][Branch1][O][N][C][C][Branch1][C][C][Branch1][C][C][O][N][=C][Ring2][Ring1][=Branch2][C][=C][Ring2][Ring1][=N][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL4289489 | [C][C][=C][C][=C][C][Branch2][Branch1][Ring1][C][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][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][Ring2][Ring1][N][=C][Ring2][Ring2][Ring1] |
CHEMBL4289490 | [C][=C][=C][C][=Branch1][C][=O][N][C][=C][C][Branch2][Ring1][S][N][C][=N][C][=C][C][Branch2][Ring1][Ring2][C][=C][N][Branch1][C][C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][O][Ring1][#Branch1][=N][Ring1][P][=C][Branch1][Ring1][O][C][C][=C][Ring2][Ring1][#Branch2][N][Branch1][C][C][C][C][N][Branch1][C][C][C] |
CHEMBL4289491 | [C][C][C][Branch1][C][O][=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][C][Ring2][Ring1][=C] |
CHEMBL4289492 | [C][C][=C][C][=C][Branch2][Ring2][Ring1][C][=C][Branch2][Ring1][C][C][=C][C][Branch1][C][F][=C][Branch1][C][O][C][Branch1][C][F][=C][Ring1][=Branch2][C][=N][C][NH1][C][=C][C][Ring2][Ring1][C][=Ring1][Branch1][C][=C][Ring2][Ring1][Branch2] |
CHEMBL4289493 | [C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Branch2][N][C][C][=Branch1][C][=O][O][C][=C][Ring1][O][C][C][C][N][Branch2][Ring1][=Branch2][C][=N][N][=C][Branch1][=Branch2][C][=C][C][=N][N][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][S][Ring1][=Branch1][C][C][Ring2][Ring1][=Branch1] |
CHEMBL4289494 | [C][O][C][=C][C][=C][Branch1][C][Br][C][Branch2][Ring2][S][C][N][C][=C][Branch2][Ring1][=C][/C][=C][\C][C][C@@H1][C@H1][C][C][C][N][C][C][C][C@H1][Branch1][=Branch2][C][N][Ring1][N][C][Ring1][S][=O][C@@H1][Ring1][=C][Ring1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][N][=C][Ring2][Ring2][Ring2] |
CHEMBL4289495 | [O][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][N][=C][S][C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][F][=N][N][Ring2][Ring1][Ring2][Ring1][N] |
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