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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00548168

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2612-ethoxyphenolX2RB10.77
D1L2-[4-(2,4-DICHLOROPHENOXY)PHENOXY]PROPANOIC ACIDA,B1UYR0.77
3CH3-CHLOROPHENOLA1LI30.71
INK(RP,SP)-O-(2R)-(1-PHENOXYBUT-2-
YL)-METHYLPHOSPHONIC ACID CHLORIDE
A1HQD0.74
TON2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOLA,B1SEZ0.7
DCNDICLOSANA,B,C,D2PD40.82
YRG(2S)-2-(4-chlorophenoxy)-3-phenylpropanoic acidA3CDP0.75
CFA(2,4-DICHLOROPHENOXY)ACETIC ACIDB,E2P1N0.79
TCLTRICLOSANA,B,C,D2PD30.77
TCLTRICLOSANA,B1P450.77
TCLTRICLOSANA,B,C,D,E,F2B350.77
TCLTRICLOSANA,B1D8A0.77
TCLTRICLOSANA,B1C140.77
TCLTRICLOSANA,B,C,D2QIO0.77
TCLTRICLOSANA,B1NHG0.77
TCLTRICLOSANA1D7O0.77
TCLTRICLOSANA,B,C,D2O2Y0.77
TCLTRICLOSANA,B1UH50.77
TCLTRICLOSANA,B2O2S0.77
TCLTRICLOSANA,B,C,D1QG60.77
TCLTRICLOSANA,B,C,D,E,F,
G,H
1QSG0.77
34C(3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACIDA,B1HT80.7
POT(1S)-1-(PHENOXYMETHYL)PROPYL METHYLPHOSPHONOCHLORIDOATEA2NW60.74
MLGN-[3-(2,4-DICHLOROPHENOXY)PROPYL]-
N-METHYL-N-PROP-2-YNYLAMINE
A,B2BXR0.74
MLGN-[3-(2,4-DICHLOROPHENOXY)PROPYL]-
N-METHYL-N-PROP-2-YNYLAMINE
A,B2BXS0.74
MLGN-[3-(2,4-DICHLOROPHENOXY)PROPYL]-
N-METHYL-N-PROP-2-YNYLAMINE
A,B,C,D1O5W0.74
2682-phenoxyethanolA2RBR0.83
258(2-chloroethoxy)benzeneX2RAY0.76