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 421 - 440 of 1486 



of 75    Go to Page   



MMs03102479
tanimoto score: 0.72

MMs03102480
tanimoto score: 0.72

MMs00482482
tanimoto score: 0.72

MMs01133839
tanimoto score: 0.72

MMs00038038
tanimoto score: 0.72

MMs02170999
tanimoto score: 0.72

MMs02155495
tanimoto score: 0.72

MMs02155494
tanimoto score: 0.72

MMs02155501
tanimoto score: 0.72

MMs03134556
tanimoto score: 0.72

MMs02155502
tanimoto score: 0.72

MMs00037334
tanimoto score: 0.72

MMs02166941
tanimoto score: 0.72

MMs01125223
tanimoto score: 0.72

MMs01125224
tanimoto score: 0.72

MMs00036980
tanimoto score: 0.72

MMs00403865
tanimoto score: 0.72

MMs01125238
tanimoto score: 0.72

MMs00403863
tanimoto score: 0.72

MMs01837421
tanimoto score: 0.72


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