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 521 - 540 of 1486 



of 75    Go to Page   



MMs01125249
tanimoto score: 0.71

MMs00187288
tanimoto score: 0.71

MMs00029229
tanimoto score: 0.71

MMs00187287
tanimoto score: 0.71

MMs01124831
tanimoto score: 0.71

MMs00187286
tanimoto score: 0.71

MMs01124830
tanimoto score: 0.71

MMs01124829
tanimoto score: 0.71

MMs01124827
tanimoto score: 0.71

MMs00027029
tanimoto score: 0.71

MMs01830922
tanimoto score: 0.71

MMs01838372
tanimoto score: 0.71

MMs00187285
tanimoto score: 0.71

MMs01124053
tanimoto score: 0.71

MMs01124052
tanimoto score: 0.71

MMs00187284
tanimoto score: 0.71

MMs01829685
tanimoto score: 0.71

MMs01068461
tanimoto score: 0.71

MMs01062990
tanimoto score: 0.71

MMs01062989
tanimoto score: 0.71


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