MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: 01W
Name: (2S)-2-ammonio-4-[(2,4-dinitrophenyl)amino]butanoate
SMILES: c1cc(c(cc1[N+](=O)[O-])[N+](=O)[O-])NCC
C(C(=O)[O-])[NH3+]

[show PDB table]

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

Neutral Molecules: 7791Ionic States: 2475Tautomers: 250Drug Similarity: 0

Items found 1 - 20 of 7791

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MMs00290651 tanimoto score: 0.94	MMs00756048 tanimoto score: 0.93	MMs00540599 tanimoto score: 0.93	MMs00540601 tanimoto score: 0.93
MMs03255812 tanimoto score: 0.93	MMs03127362 tanimoto score: 0.92	MMs02388888 tanimoto score: 0.92	MMs03127371 tanimoto score: 0.92
MMs03127370 tanimoto score: 0.92	MMs03916360 tanimoto score: 0.92	MMs02388861 tanimoto score: 0.92	MMs02388892 tanimoto score: 0.91
MMs00755921 tanimoto score: 0.91	MMs02388886 tanimoto score: 0.91	MMs03127624 tanimoto score: 0.91	MMs03127404 tanimoto score: 0.91
MMs00024825 tanimoto score: 0.91	MMs01529908 tanimoto score: 0.91	MMs02388868 tanimoto score: 0.91	MMs03127368 tanimoto score: 0.91