MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: OI1
Name: 3-(4-HYDROXYBENZYL)-2-[1-({[2-(4-HYDROXYPHENYL)ETHYL]AMINO}CARBONYL)BUTYL]-4-OXO-3,6,11,11A-
TETRAHYDRO-4H-PYRAZINO[1,2-B]ISOQUINOLIN-2-IUM-1-OLATE
SMILES: CCCC(C(=O)NCCc1ccc(cc1)O)[N+]2=C(C3Cc
4ccccc4CN3C(=O)C2Cc5ccc(cc5)O)[O-]

[show PDB table]

MMsINC molecules which have a Tanimoto coefficient superior or equal to 0.70

Neutral Molecules: 5752Ionic States: 4680Tautomers: 1561Drug Similarity: 32

Items found 21 - 40 of 5752

of 288 Go to Page

MMs02480335 tanimoto score: 0.81	MMs02290337 tanimoto score: 0.81	MMs02290338 tanimoto score: 0.81	MMs02480129 tanimoto score: 0.81
MMs03927430 tanimoto score: 0.81	MMs03927431 tanimoto score: 0.81	MMs03678502 tanimoto score: 0.81	MMs02480128 tanimoto score: 0.81
MMs02290336 tanimoto score: 0.81	MMs00027968 tanimoto score: 0.81	MMs02480337 tanimoto score: 0.81	MMs03927352 tanimoto score: 0.81
MMs00698036 tanimoto score: 0.8	MMs00745035 tanimoto score: 0.8	MMs00745037 tanimoto score: 0.8	MMs03167068 tanimoto score: 0.8
MMs00027973 tanimoto score: 0.8	MMs00034331 tanimoto score: 0.8	MMs00697847 tanimoto score: 0.8	MMs00698035 tanimoto score: 0.8

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