MMsINC Database Search
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Ligand PDB



ligand: 3IN
Name: N-[2(S)-CYCLOPENTYL-1(R)-HYDROXY-3(R)METHYL]-5-[(2(S)-TERTIARY-BUTYLAMINO-CARBONYL)-4-(N1-(2)-
(N-METHYLPIPERAZINYL)-3-CHLORO-PYRAZINYL-5-CARBONYL)-PIPERAZINO]-4(S)-HYDROXY-2(R)-PHENYLMETHYL-
PENTANAMIDE
SMILES: CC1CCC(C1NC(=O)C(Cc2ccccc2)CC(CN3CCN(CC3C(=O)NC(C)(C)C)C(=O)c4cnc(c(n4)Cl)N5CCN(
CC5)C)O)O
[show PDB table]


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

Neutral Molecules: 1486Ionic States: 477Tautomers: 27Drug Similarity: 13 Items found 321 - 340 of 1486 



of 75    Go to Page   



MMs02170999
tanimoto score: 0.72

MMs00063090
tanimoto score: 0.72

MMs00658143
tanimoto score: 0.72

MMs00658142
tanimoto score: 0.72

MMs02025034
tanimoto score: 0.72

MMs01846325
tanimoto score: 0.72

MMs00029701
tanimoto score: 0.72

MMs01846327
tanimoto score: 0.72

MMs02025035
tanimoto score: 0.72

MMs01830856
tanimoto score: 0.72

MMs00063091
tanimoto score: 0.72

MMs02155494
tanimoto score: 0.72

MMs02155501
tanimoto score: 0.72

MMs02155502
tanimoto score: 0.72

MMs01830833
tanimoto score: 0.72

MMs01830857
tanimoto score: 0.72

MMs01830832
tanimoto score: 0.72

MMs01837421
tanimoto score: 0.72

MMs01817096
tanimoto score: 0.72

MMs00221618
tanimoto score: 0.72


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