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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02405349

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
GC71-GUANIDINIUM-7-AMINOHEPTANEA,B1RQD0.76
2EP2-ETHYLPIPERIDINEH,I1A4W0.81
FXY1-METHYLHEPTYLFORMAMIDEA,B1U3W0.82
DIAOCTANE 1,8-DIAMINEA,B3BI50.76
DIAOCTANE 1,8-DIAMINEA,B,C1H830.76
NMH(R)-N-(1-METHYL-HEXYL)-FORMAMIDEA,B,C,D1P1R0.79
DIXMETHYL(CYCLOPENTYL-PROPYL)AMINEC,D1A1C0.77
HPLHEPTYLFORMAMIDEA,B1U3V0.74
DIY5-BUTYLPIPERIDINEC,D1A1E0.73
297dodecane-1,12-diamineA,B3BI20.76
SPZ(3S,3'S)-N~1~,N~1~'-butane-1,4-
diyldibutane-1,3-diamine
A,B3BNU0.75
SPJ(3R,3'R)-N~1~,N~1~'-butane-1,4-
diyldibutane-1,3-diamine
A,B3BNM0.75
DREN-(6-AMINOHEXYL)HEXANE-1,6-DIAMINEA,B1Z6L0.79
CATDODECANE-TRIMETHYLAMINEA,B2SHP0.74
DIPDIPENTYLAMINEC,D1A1B0.82
DIPDIPENTYLAMINEC,D1A070.82
DIPDIPENTYLAMINEC,D1A1A0.82
DIPDIPENTYLAMINEC,D1A080.82
DIPDIPENTYLAMINEC,D1A090.82
16ACETYL-TRIMETHYL-AMMONIUMA3HF00.71
16ACETYL-TRIMETHYL-AMMONIUMA,B,C,D1KPG0.71
16ACETYL-TRIMETHYL-AMMONIUMA1TPY0.71