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 581 - 600 of 1486 



of 75    Go to Page   



MMs00028937
tanimoto score: 0.71

MMs01009798
tanimoto score: 0.71

MMs00030554
tanimoto score: 0.71

MMs00318721
tanimoto score: 0.71

MMs01990568
tanimoto score: 0.71

MMs02039053
tanimoto score: 0.71

MMs01858233
tanimoto score: 0.71

MMs00318720
tanimoto score: 0.71

MMs00143231
tanimoto score: 0.71

MMs00318693
tanimoto score: 0.71

MMs01858232
tanimoto score: 0.71

MMs00318692
tanimoto score: 0.71

MMs01009536
tanimoto score: 0.71

MMs00318681
tanimoto score: 0.71

MMs01009535
tanimoto score: 0.71

MMs01009524
tanimoto score: 0.71

MMs00030552
tanimoto score: 0.71

MMs01968420
tanimoto score: 0.71

MMs02094902
tanimoto score: 0.71

MMs01009523
tanimoto score: 0.71


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