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 261 - 280 of 1486 



of 75    Go to Page   



MMs02381118
tanimoto score: 0.72

MMs02381886
tanimoto score: 0.72

MMs02356809
tanimoto score: 0.72

MMs00330931
tanimoto score: 0.72

MMs00330930
tanimoto score: 0.72

MMs02350299
tanimoto score: 0.72

MMs00033725
tanimoto score: 0.72

MMs02351121
tanimoto score: 0.72

MMs02347104
tanimoto score: 0.72

MMs02347883
tanimoto score: 0.72

MMs02351504
tanimoto score: 0.72

MMs02291532
tanimoto score: 0.72

MMs00026132
tanimoto score: 0.72

MMs00325486
tanimoto score: 0.72

MMs00325485
tanimoto score: 0.72

MMs02353987
tanimoto score: 0.72

MMs00325460
tanimoto score: 0.72

MMs00325459
tanimoto score: 0.72

MMs02227371
tanimoto score: 0.72

MMs00017009
tanimoto score: 0.72


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