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 161 - 180 of 1486 



of 75    Go to Page   



MMs00033587
tanimoto score: 0.73

MMs00328077
tanimoto score: 0.73

MMs00330915
tanimoto score: 0.73

MMs01170846
tanimoto score: 0.73

MMs02656270
tanimoto score: 0.73

MMs01154931
tanimoto score: 0.73

MMs00327747
tanimoto score: 0.73

MMs00327750
tanimoto score: 0.73

MMs00009598
tanimoto score: 0.73

MMs01154487
tanimoto score: 0.73

MMs02456512
tanimoto score: 0.73

MMs00028925
tanimoto score: 0.73

MMs01316270
tanimoto score: 0.73

MMs00030192
tanimoto score: 0.73

MMs00141518
tanimoto score: 0.73

MMs00141517
tanimoto score: 0.73

MMs00028924
tanimoto score: 0.73

MMs01154486
tanimoto score: 0.73

MMs02656271
tanimoto score: 0.73

MMs01137156
tanimoto score: 0.73


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