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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02216523

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3PA3-CYCLOPENTYL-PROPIONIC ACIDC1FAV0.71
3OC(1R)-3-oxocyclohexanecarboxylic acidA,B3DZL0.75
TWN(3S)-3-[(2S,3S,4R)-3,4-DIMETHYLTETRAHYDROFURAN-
2-YL]BUTYL LAURATE
A,B2IVD0.72
TWN(3S)-3-[(2S,3S,4R)-3,4-DIMETHYLTETRAHYDROFURAN-
2-YL]BUTYL LAURATE
A,B2IVE0.72
CXPCYCLOHEXANE PROPIONIC ACIDA,B2AY20.76
NONMETHYL NONANOATE (ESTER)A1QQS0.72
NONMETHYL NONANOATE (ESTER)H1CLZ0.72
NONMETHYL NONANOATE (ESTER)H1CLY0.72
LNG12-METHYLTRIDECANOIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.71
KTA(S)-CYCLOHEXANONE-2-ACETATEA,B2J5S0.7