MMsINC Ligand

MMsINC Database Search


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Ligand PDB

ligand: I5S
Name: ISOQUINOLINE-5-SULFONIC ACID (2-(2-(4-CHLOROBENZYLOXY)ETHYLAMINO)ETHYL)AMIDE
SMILES: c1cc2cnccc2c(c1
)S(=O)(=O)NCCNCCOCc3ccc(cc3)Cl

[show PDB table]

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

Neutral Molecules: 5829Ionic States: 997Tautomers: 67Drug Similarity: 4

Items found 1 - 20 of 5829

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MMs03541123 tanimoto score: 0.87	MMs03801647 tanimoto score: 0.84	MMs01262406 tanimoto score: 0.81	MMs00937140 tanimoto score: 0.81
MMs03617174 tanimoto score: 0.81	MMs00937129 tanimoto score: 0.81	MMs00515832 tanimoto score: 0.81	MMs01589738 tanimoto score: 0.8
MMs00875943 tanimoto score: 0.8	MMs02760571 tanimoto score: 0.8	MMs00875934 tanimoto score: 0.8	MMs00850417 tanimoto score: 0.8
MMs01454666 tanimoto score: 0.8	MMs00060682 tanimoto score: 0.8	MMs01456034 tanimoto score: 0.8	MMs00515862 tanimoto score: 0.8
MMs01377158 tanimoto score: 0.8	MMs00501409 tanimoto score: 0.8	MMs00875939 tanimoto score: 0.8	MMs01381842 tanimoto score: 0.8