chembl_id
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CHEMBL8797 | [C][C][C][C][C][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][#C][O][C][C][=C][C][=C][C][Branch1][Ring1][C][#N][=C][Ring1][Branch2][=C][Ring1][S] |
CHEMBL9098 | [O][=C][Branch2][Ring1][=Branch1][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][#Branch2][F][C][=C][C][=C][N][Ring1][Branch1][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][O] |
CHEMBL8816 | [N][#C][N][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][Ring2] |
CHEMBL8817 | [C][N][C][C][C@@H1][Branch2][Ring2][Ring2][C][=C][Branch1][C][O][C][=C][Branch1][C][O][C][C][=Branch1][C][=O][C][=C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][O][C][Ring2][Ring1][Ring2][=Ring1][=C][C@@H1][Branch1][C][O][C][Ring2][Ring1][O] |
CHEMBL8818 | [C][C][C][C][C][C][Branch1][C][O][C][=C][C][=C][C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][=C] |
CHEMBL8841 | [C][C][C][C][C][C][Branch1][C][O][C][=C][C][=C][C][Branch2][Ring1][Ring1][O][C][C][=C][C][=C][C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][=N][Ring1][#Branch2][=C][Ring2][Ring1][C] |
CHEMBL1163249 | [C][O][C][=N][O][C][C][C][C][C][Branch1][#Branch1][C][C][Ring1][#Branch2][Ring1][#Branch1][N][Ring1][#Branch1].[O][=C][Branch1][C][O][/C][=C][/C][=Branch1][C][=O][O] |
CHEMBL8843 | [C][C][Branch1][C][C][Branch1][C][C][C][=C][C][Branch1][=C][/C][=C][/C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=C][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=C][Ring2][Ring1][Ring1][O] |
CHEMBL8844 | [C][=C][C][C][Branch1][#Branch1][C][C][C][C][Ring1][Branch1][O][C][Ring1][=Branch2][=O] |
CHEMBL8845 | [C][C][C][=Branch1][C][=O][N][N][=C][Branch1][N][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][C][=C][C][=C][Branch1][O][C][=C][Ring1][=Branch1][C][C][Ring2][Ring1][C][C][O][C][O][Ring1][#Branch2] |
CHEMBL9146 | [C][C][Branch1][C][C][C][=Branch1][C][=O][N][Branch2][Ring1][#Branch1][C][=C][C][=C][Branch1][Ring1][C][#N][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][N][C][=Branch1][C][=O][N][Ring2][Ring1][Ring2][C][C][=C][C][=C][C][Branch1][C][I][=C][Ring1][#Branch1] |
CHEMBL9147 | [C][O][C][C][N][C][=Branch1][C][=O][C][N][C][C@@H1][Branch1][S][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][C@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C@H1][Ring1][P][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2] |
CHEMBL9148 | [C][/C][=C][/C][=C][/C][=Branch1][C][=O][O][C@H1][Branch1][Branch2][C][C][=C][Branch1][C][C][C][C][=C][C][=Branch1][C][=O][C][=C][Branch1][C][O][C][=C][C][Branch1][C][O][=C][Ring1][Branch2][C][Ring1][=N][=O] |
CHEMBL9149 | [C][C][C][C][O][C][=C][C][=C][Branch2][Ring1][Ring1][/C][=C][/C][=C][C][=C][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][=C][Ring1][#Branch2][C][=C][Ring2][Ring1][C] |
CHEMBL8799 | [C][C][C][C][C][C][C][C][C][C][=Branch1][C][=O][N][C@H1][C][C][O][C][Ring1][Branch1][=O] |
CHEMBL8889 | [C][C][C@][Branch1][Ring1][C][O][C][C][C][C][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][Ring1][N][Branch1][#Branch1][C][C][N][Ring1][=C][C][C][Branch1][Ring2][O][Ring1][=Branch2][C@@H1][Ring2][Ring1][#Branch1][O] |
CHEMBL8890 | [C][C][Branch1][C][C][O][C][=C][C][=C][C][Branch2][Branch1][C][N][C][Branch2][Ring1][#C][N][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][=C][Ring1][=N][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][N][=O][=C][Ring2][Ring2][Ring1] |
CHEMBL8891 | [O][=C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][N][C][=C][C][=C][N][Ring1][Branch1][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][O] |
CHEMBL8893 | [O][=C][Branch2][Ring1][#Branch1][N][C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2] |
CHEMBL8819 | [O][=C][Branch1][N][N][C][C][C][N][C][=C][N][=C][Ring1][Branch1][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][=Branch2][Cl] |
CHEMBL8820 | [C][C][C][C][/C][=C][/C][=C][C][=C][Branch2][Ring1][Ring1][O][C][C][=C][C][=C][C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][#Branch2][C][=C][Ring2][Ring1][C] |
CHEMBL1778261 | [C][O][C][=C][C][Branch2][Ring2][C][C][NH1][C][=Branch1][C][=O][NH1][C][=Ring1][=Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][O][O][C] |
CHEMBL8916 | [C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O] |
CHEMBL8917 | [C][C][C][C][C@@H1][Branch2][Branch1][=Branch1][C][C@@H1][Branch2][Ring1][O][C][C][C][=C][C][=C][Branch1][#C][C][=C][C][Branch1][C][Cl][=C][C][Branch1][C][Cl][=C][Ring1][Branch2][C][=C][Ring1][=C][C][=Branch1][C][=O][N][C@H1][Branch1][#Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][O] |
CHEMBL8938 | [C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C@H1][Branch1][C][O][C@][Branch1][Ring1][C][O][Branch1][N][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][Branch1][Branch1][C][Ring2][Ring1][#Branch1][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][C][C][Ring2][Ring1][=C][Ring1][O][Ring2][Ring1][O] |
CHEMBL8939 | [C][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][N] |
CHEMBL8940 | [C][C][C][C][C][/C][=C][/C][/C][=C][/C][C][C][C][C][C][C][C][=Branch1][C][=O][O][C@H1][Branch1][Branch2][C][C][=C][Branch1][C][C][C][C][=C][C][=Branch1][C][=O][C][=C][Branch1][C][O][C][=C][C][Branch1][C][O][=C][Ring1][Branch2][C][Ring1][=N][=O] |
CHEMBL8942 | [C][S][C][=C][C][=C][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=C][N][Ring1][Branch1][C][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring2][Ring1][Ring2] |
CHEMBL9235 | [C][#C][C][=C][C][=C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][N][Ring1][Branch1][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][O][C][=C][Ring2][Ring1][Ring1] |
CHEMBL9237 | [C][O][P][=Branch1][C][=O][Branch2][Ring1][Ring1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@@H1][C][C][C][N][Ring1][Branch1].[Cl] |
CHEMBL67 | [C][O][C][=C][C][=C][Branch2][Ring1][#Branch1][/C][=C][\C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][N][C][=C][Ring2][Ring1][Ring2][O] |
CHEMBL9238 | [C][O][C][=Branch1][C][=O][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Branch1][Ring1][O][P][=Branch1][C][=O][Branch2][Ring1][=Branch2][O][C][=C][C][=C][Branch1][=C][C][=Branch1][C][=O][N][C][C][C][=Branch1][C][=O][O][C][C][=C][Ring1][#C][C][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][N][Ring1][Branch1][C][=C][Ring2][Ring2][Branch1].[Cl] |
CHEMBL9239 | [C][C][C][N][C][=Branch1][C][=O][C][N][=C][Branch2][Ring2][#Branch1][C][=C][C][=C][Branch2][Ring1][O][O][C][C][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][C][C][S][S][C][=C][C][=C][C][=N][Ring1][=Branch1][C][=C][Ring2][Ring1][#Branch2][NH1][C][=Ring2][Ring1][#C][N][Branch1][Ring2][C][C][C][C][Ring2][Ring2][#Branch1][=O] |
CHEMBL9240 | [C][N][C][=O] |
CHEMBL9241 | [C][O][C][=C][C][Branch1][P][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][O][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][C][O][C] |
CHEMBL8982 | [C][N][Branch1][C][C][C][C][=C][C][=C][Branch1][P][C][S][C][C][N][C][=N][S+1][Branch1][C][O-1][N][=C][Ring1][=Branch1][N][O][Ring1][P] |
CHEMBL8983 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch2][Branch1][C][C][C][C][N+1][Branch1][C][C][Branch1][C][C][C][C][C][C][C][C][N+1][Branch1][C][C][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O][C][Ring2][Ring2][=Branch1][=O].[Br-1].[Br-1] |
CHEMBL8986 | [C][C][=C][C][=C][Branch1][S][C][=Branch1][C][=O][N][C][C][C][N][C][=C][N][=C][Ring1][Branch1][S][Ring1][S] |
CHEMBL8987 | [O][=C][Branch1][N][N][C][C][C][N][C][=C][N][=C][Ring1][Branch1][C][=C][C][=C][Branch1][C][Cl][S][Ring1][=Branch1] |
CHEMBL8988 | [O][=C][Branch1][N][N][C][C][C][N][C][=C][N][=C][Ring1][Branch1][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2] |
CHEMBL8989 | [C][N][Branch1][C][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][Branch1][C][N][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][Ring1][O] |
CHEMBL9078 | [C][O][C@H1][C][C][C][Branch1][C][C][C][=Branch2][Ring1][P][=C][C][C][C][Ring1][#Branch1][C][C][C][Branch1][C][C][C][Ring1][#Branch1][C][C][C@@H1][Ring1][=Branch1][N][Branch1][C][C][C][C][C][C][Branch1][C][C][C][C][Ring2][Ring1][O] |
CHEMBL8918 | [O][=C][Branch1][N][N][C][C][C][N][C][=C][N][=C][Ring1][Branch1][C][=C][C][=C][O][Ring1][Branch1] |
CHEMBL8919 | [C][C][C][C][C][C][Branch1][Ring1][O][C][C][=C][C][=C][C][Branch2][Ring1][Ring1][O][C][C][=C][C][=C][C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][#Branch2][=C][Ring2][Ring1][C] |
CHEMBL8920 | [C][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring2][Branch1][N][C][=Branch1][C][=O][N][N][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][O][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][=C][Ring2][Ring1][=C] |
CHEMBL9007 | [C][C][=C][C][Branch1][C][C][=C][Branch1][C][C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O][=C][Ring2][Ring1][Ring1][C] |
CHEMBL9030 | [C][N][C][=Branch1][C][=O][C][N][=C][Branch2][Ring2][Ring2][C][=C][C][=C][Branch2][Ring1][Branch2][S][=Branch1][C][=O][=Branch1][C][=O][O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][=C][Ring2][Ring1][Ring1][NH1][C][=Ring2][Ring1][Branch2][N][Branch1][C][C][C][Ring2][Ring1][=C][=O] |
CHEMBL9031 | [C][C][C][C][C][C][C][C][C][C][C][=Branch1][C][=O][N][C@H1][C][C][O][C][Ring1][Branch1][=O] |
CHEMBL9032 | [C][C][C][N][Branch1][Ring2][C][C][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][Branch1][C][N][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][Ring1][O] |
CHEMBL9033 | [C][C][C][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][Branch1][C][N][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][Ring1][O] |
CHEMBL9034 | [C][N][C][=Branch1][C][=O][C][N][=C][Branch2][Ring2][Ring2][C][=C][C][=C][Branch2][Ring1][Branch2][S][=Branch1][C][=O][=Branch1][C][=O][O][C][=C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][=Branch2][C][=C][Ring2][Ring1][Ring1][NH1][C][=Ring2][Ring1][Branch2][N][Branch1][C][C][C][Ring2][Ring1][=C][=O] |
CHEMBL9412 | [C][C][C][C][=Branch1][C][=O][O][C][C@][C][C@@H1][Branch1][C][O][C@H1][Branch1][C][C][C][C@H1][Ring1][Branch2][O][C@@H1][C][C@@H1][Branch2][Ring1][O][O][C][=Branch1][C][=O][/C][=C][\C][=C][\C][Branch1][=Branch1][C][Branch1][C][C][O][O][C@H1][Branch1][C][O][C][Ring2][Ring1][P][C@@][Ring2][Ring1][N][Branch1][C][C][C][Ring2][Ring1][Branch1][C][O][Ring1][Ring1] |
CHEMBL9413 | [C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][=N][C][=C][C][Ring1][=Branch1][=N][Ring1][#Branch2] |
CHEMBL9414 | [F][C][Branch1][C][F][Branch1][C][F][C@H1][C][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][N][Ring1][O] |
CHEMBL9415 | [N][N][C][Branch1][C][N][C][=C][C][=C][Branch2][Ring2][=Branch2][C][C@H1][Branch2][Ring1][#Branch1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][#Branch1][C][=C][Ring2][Ring1][#C] |
CHEMBL9417 | [N][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][O][C@@H1][Branch1][C][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL9418 | [N][C][=C][C][=C][C][Branch1][#C][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][S] |
CHEMBL9079 | [C][N][C][=C][Branch1][#C][C][=C][S][C][Branch1][=Branch1][C][Branch1][C][N][=O][=N][Ring1][Branch2][C][=C][Ring1][=N][C][=Branch1][C][=O][C][=C][Branch1][C][N][C][Ring1][Branch2][=O] |
CHEMBL9081 | [2H][C][Branch1][C][2H][Branch1][C][2H][N][C][=O] |
CHEMBL9083 | [C][N][Branch1][C][C][C][=C][C][=C][C][Branch2][Ring2][#Branch1][N][C][Branch2][Ring1][Ring2][N][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][Ring1][C][#N][=C][Ring1][Branch2][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][#Branch1][=O][=C][Ring2][Ring1][=C] |
CHEMBL8800 | [C][N][N][=N][N][=C][Ring1][Branch1][C][=Branch1][=N][=C][\C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][/C][=C][/C][Branch1][C][O][C][C][Branch1][C][O][C][C][=Branch1][C][=O][O-1].[Na+1] |
CHEMBL9009 | [C][C][=C][C][=C][C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][N][Ring1][Branch1][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][O][=C][Ring2][Ring1][Ring1] |
CHEMBL9010 | [C][C][=C][C][=C][C][Branch2][Ring2][Ring2][N][C][=Branch1][C][=O][N][N][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=C][Ring2][Ring1][=N] |
CHEMBL9011 | [C][O][C][=C][C][=C][Branch2][Ring1][=Branch2][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][Branch1][C][N][=C][Ring2][Ring1][Branch1] |
CHEMBL9099 | [C][C][O][C][=Branch1][C][=O][/C][=C][Branch1][C][C][/C][Branch1][C][F][=C][/C][=C][Branch1][C][C][/C][=C][/C][=C][Branch1][C][Cl][C][=C][Branch1][Ring1][O][C][C][Branch1][C][C][=C][Ring1][#Branch2][C] |
CHEMBL9102 | [C][C][C][C][C@@H1][Branch2][Branch1][#Branch2][C][C@@H1][Branch2][Ring1][Branch2][C][C][C][=C][C][=C][Branch1][N][C][=C][C][=C][C][Branch1][C][N][=C][Ring1][#Branch1][C][=C][Ring1][=N][C][=Branch1][C][=O][N][C@H1][Branch1][=C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][O] |
CHEMBL8753 | [C][C][C][C][C@@H1][Branch2][Branch1][Ring1][C][C@@H1][Branch2][Ring1][Branch2][C][C][C][=C][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][=C][Ring1][=N][C][=Branch1][C][=O][N][C@H1][Branch1][#Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][O] |
CHEMBL8754 | [O][=C][Branch1][O][N][C][C][N][C][=C][N][=C][Ring1][Branch1][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][=Branch2][Cl] |
CHEMBL8755 | [C][C][C][C][C][C][C][C][C][C][C][C][=Branch1][C][=O][N][C@H1][C][C][O][C][Ring1][Branch1][=O] |
CHEMBL8757 | [C][C][N][C][Branch2][Ring2][P][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][=C][C][=C][Branch1][=N][C][=C][Ring1][=Branch1][S][Ring2][Ring2][Branch2][=Branch1][C][=O][=O][O][C][C][O][Ring1][O] |
CHEMBL8758 | [O][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch2][Ring1][=C][C][C][=C][C][=C][Branch1][S][C][Branch1][C][F][Branch1][C][F][P][=Branch1][C][=O][Branch1][C][O][O][C][Branch1][C][Br][=C][Ring1][=C][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL8759 | [N][C@@][Branch1][=Branch1][C][=Branch1][C][=O][O][C][C][C@H1][C@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C@H1][Ring1][=Branch1][Ring1][N] |
CHEMBL8777 | [C][C][C][=C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][N][C][=C][N][=C][Ring1][Branch1][C][C][=C][Ring1][N][C][N][C][Ring1][P][=O] |
CHEMBL8778 | [O][=C][Branch1][=N][N][C][C][C][C][N][C][=C][N][=C][Ring1][Branch1][C][=C][C][=C][S][Ring1][Branch1] |
CHEMBL8779 | [O][=C][Branch2][Ring1][#Branch1][N][C][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2] |
CHEMBL1163248 | [C][N][C][=C][N+1][Branch1][C][C][=C][Ring1][=Branch1][/C][=C][/C][=C][C][=C][Branch1][Branch2][C][=C][C][=C][S][Ring1][Branch1][S][Ring1][#Branch2].[I-1] |
CHEMBL8780 | [C][C][O][C][=Branch1][C][=O][C][C][=C][C][=C][C][Branch1][C][N][=C][C][=C][Ring1][#Branch1][N][=C][Branch1][C][O][N][Ring1][N][N][=Ring1][#C] |
CHEMBL8869 | [O][=C][Branch1][N][N][C][C][C][N][C][=C][N][=C][Ring1][Branch1][C][S][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][C][=Ring1][#Branch2][Cl] |
CHEMBL8801 | [C][C][N][Branch1][Ring1][C][C][C][C][N][C][=C][C][=C][N][=C][N][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2][C][=Branch1][C][=O][C][Ring2][Ring1][Ring2][=C][Ring2][Ring1][C][Ring1][#C] |
CHEMBL8802 | [C][C][C][C][C][C][Branch1][C][O][C][=C][C][=C][C][Branch2][Ring1][C][O][C][C][=C][C][=C][C][Branch1][=Branch1][C][Branch1][C][N][=O][=C][Ring1][=Branch2][=C][Ring1][P] |
CHEMBL8804 | [C][C][Branch1][C][C][=C][C][C@@H1][Branch1][#C][O][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=Branch1][C][=O][C][=C][Branch1][C][O][C][=C][C][Branch1][C][O][=C][Ring1][Branch2][C][Ring1][=N][=O] |
CHEMBL8805 | [C][C][Branch1][C][C][=C][C][C@@H1][Branch1][=C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=Branch1][C][=O][C][=C][Branch1][C][O][C][=C][C][Branch1][C][O][=C][Ring1][Branch2][C][Ring1][=N][=O] |
CHEMBL9103 | [O][=C][Branch1][N][N][C][C][C][N][C][=C][N][=C][Ring1][Branch1][C][=C][C][=C][S][Ring1][Branch1] |
CHEMBL9104 | [C][C][Branch1][C][C][C][C][C][C][Branch1][C][C][C][C][C][C][C][C][C][=C][C][C][Branch2][Ring2][N][O][C][C][O][C][C][O][C][C][O][C][C][O][P][Branch1][C][O][=Branch1][C][=S][O][C][C][S][C][O][C][Branch1][Ring1][C][O][C][Branch1][C][O][C][Branch1][C][O][C][Ring1][#Branch2][O][C][C][C][Ring2][Ring2][Branch1][Branch1][C][C][C][Ring2][Ring2][#Branch2][C][C][C][Ring2][Ring2][P][Ring2][Ring2][=C][C] |
CHEMBL9106 | [C][C][C][C][C][C][C][C][C][C][C][Ring1][Ring1][C][C][C][C][C][C][C][C][=Branch1][C][=O][O] |
CHEMBL8823 | [C][C][C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C@@H1][Branch2][Ring1][Ring2][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][O][C][C][=Branch1][C][=O][O][C@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C@H1][Ring2][Ring1][=Branch1][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1] |
CHEMBL8824 | [C][C][C][C][C][C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][=C][C][=C][C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][#Branch2] |
CHEMBL8846 | [C][C][Branch1][C][C][Branch1][C][C][C][=C][C][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][S][Ring1][Branch1][=C][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=C][Ring1][P][O] |
CHEMBL8847 | [C][C][C][C][C@@H1][Branch2][Branch1][#Branch1][C][C@@H1][Branch2][Ring1][N][C][C][C][=C][C][=C][Branch1][S][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][N][=O][C][=C][Ring1][=Branch2][C][=C][Ring1][#C][C][=Branch1][C][=O][N][C@H1][Branch1][#Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][O] |
CHEMBL8848 | [C][=C][=C][Branch1][Ring1][C][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CHEMBL8849 | [C][C][C][/C][=C][/C][C][C][C][C][C][C][=Branch1][C][=O][C][C][=Branch1][C][=O][N][C@H1][C][C][O][C][Ring1][Branch1][=O] |
CHEMBL8850 | [O][=C][Branch1][N][N][C][C][C][N][C][=N][C][=N][Ring1][Branch1][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][=Branch2] |
CHEMBL8857 | [C][C][C@H1][Branch1][C][C][C@H1][Branch2][Branch1][O][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][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C@H1][Branch1][=Branch1][C][C][C][C][N][N][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][O] |
CHEMBL8870 | [O][=C][Branch1][N][N][C][C][C][N][C][=C][N][=C][Ring1][Branch1][C][=C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][S][Ring1][#Branch2] |
CHEMBL8871 | [C][C][=C][C][=C][C][Branch1][=N][S][C][=C][N][=C][Branch1][C][O][N][=C][Ring1][#Branch1][=C][Ring1][=C] |
CHEMBL8872 | [C][C][=C][C][=C][Branch1][=N][S][C][=C][N][=C][Branch1][C][O][N][=C][Ring1][#Branch1][C][=C][Ring1][=C] |
CHEMBL8873 | [C][C][C@@H1][/C][=C][Branch1][C][\C][C][C@H1][Branch1][C][C][C][C@H1][Branch1][Ring1][O][C][C@H1][O][C@@][Branch1][C][O][Branch2][=Branch1][#Branch1][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][O][C@H1][Branch2][Ring1][S][/C][Branch1][C][C][=C][/C@@H1][C][C][C@@H1][Branch1][=N][O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C@H1][Branch1][Ring1][O][C][C][Ring1][S][C@H1][Branch1][C][C][C@@H1][Branch1][C][O][C][C][Ring2][Branch1][=Branch1][=O][C@H1][Branch1][C][C][C][C@@H1][Ring2][Ring2][S][O][C] |
CHEMBL8877 | [C][=C][=C][Branch1][Ring1][C][N][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1] |
CHEMBL8878 | [C][C][C][C][O][C][C][N][C][C@@H1][Branch1][S][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][C@H1][Branch1][=Branch1][C][=Branch1][C][=O][O][C@H1][Ring1][P][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2] |
CHEMBL8895 | [C][C][C][C][Branch1][Branch2][C][C][=Branch1][C][=O][N][C][=N][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][S][C][=C][C][=C][C][=C][Ring1][=Branch1] |
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