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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03378147

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
4DI4-(DIMETHYLAMINO)BUTYL IMIDOTHIOCARBAMATEA,B2AOV0.71
BCH2-(BUTYRYLSULFANYL)-N,N,N-TRIMETHYLETHANAMINIUMA1P0P0.77
BCH2-(BUTYRYLSULFANYL)-N,N,N-TRIMETHYLETHANAMINIUMA,B2HA70.77
ETM2-(TRIMETHYLAMMONIUM)ETHYL THIOLA1QXA0.72
ETM2-(TRIMETHYLAMMONIUM)ETHYL THIOLA2C580.72
ETM2-(TRIMETHYLAMMONIUM)ETHYL THIOLA,B2HA70.72
ETM2-(TRIMETHYLAMMONIUM)ETHYL THIOLA1QWZ0.72
ETM2-(TRIMETHYLAMMONIUM)ETHYL THIOLA2C5G0.72
ETM2-(TRIMETHYLAMMONIUM)ETHYL THIOLA,B2HA50.72
AT3ACETYLTHIOCHOLINEA2C580.73
AT3ACETYLTHIOCHOLINEA2C4H0.73
AT3ACETYLTHIOCHOLINEA,B2HA50.73