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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02273481

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DIB3-AMINO-(DIMETHYLPROPYLAMINE)A,D,E,G,I,J1S320.72
DIB3-AMINO-(DIMETHYLPROPYLAMINE)E,I,J1M1A0.72
DIB3-AMINO-(DIMETHYLPROPYLAMINE)D,I,J1M180.72
DIB3-AMINO-(DIMETHYLPROPYLAMINE)E,I,J1M190.72
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H
1CE80.81
NETTETRAETHYLAMMONIUM IONB,C,E,F,H,I,
K,L
1JDB0.81
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,G,H1BXR0.81
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H
1KEE0.81
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H
1C300.81
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H
1T360.81
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H
1C3O0.81
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H
1A9X0.81
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H
1CS00.81
NETTETRAETHYLAMMONIUM IONA,B,C,D,E,F,
G,H
1M6V0.81
DR8N,N,N-TRIMETHYLHEPTA-1,3,5-TRIYN-
1-AMINIUM
A2ASC0.73
NBNN-BUTYL ISOCYANIDEA108M0.71
NBNN-BUTYL ISOCYANIDEA,B1NBB0.71
NBNN-BUTYL ISOCYANIDEA103M0.71
NBNN-BUTYL ISOCYANIDEA,B2HBE0.71
NBNN-BUTYL ISOCYANIDEA1GEJ0.71
NBNN-BUTYL ISOCYANIDEA111M0.71
NBNN-BUTYL ISOCYANIDEA1GEK0.71
NBNN-BUTYL ISOCYANIDEA101M0.71
NBNN-BUTYL ISOCYANIDEA104M0.71
NBNN-BUTYL ISOCYANIDEA2MYC0.71
NBNN-BUTYL ISOCYANIDEA1GEI0.71
NBNN-BUTYL ISOCYANIDEA1GEM0.71
NBNN-BUTYL ISOCYANIDEA105M0.71
NBNN-BUTYL ISOCYANIDEA107M0.71
NBNN-BUTYL ISOCYANIDEA,B1S610.71
TBATETRABUTYLAMMONIUM IONI,L2BOB0.79
TBATETRABUTYLAMMONIUM IONA,C2DWD0.79
TBATETRABUTYLAMMONIUM IONA,C2HVJ0.79
TBATETRABUTYLAMMONIUM IONC2DWE0.79
TBATETRABUTYLAMMONIUM IONA,B1J950.79
TBATETRABUTYLAMMONIUM IONA,C2HVK0.79
TBATETRABUTYLAMMONIUM IONA1JVM0.79
TBATETRABUTYLAMMONIUM IONC2HJF0.79
CATDODECANE-TRIMETHYLAMINEA,B2SHP0.7
NPNN-PROPYL ISOCYANIDEA,B2HBF0.7
NPNN-PROPYL ISOCYANIDEA2MYD0.7
NPNN-PROPYL ISOCYANIDEA112M0.7