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 81 - 100 of 1486 



of 75    Go to Page   



MMs00243415
tanimoto score: 0.75
MMs00016987
tanimoto score: 0.75
MMs02279397
tanimoto score: 0.75
MMs01135114
tanimoto score: 0.75

MMs02626916
tanimoto score: 0.75
MMs01135116
tanimoto score: 0.75
MMs02410606
tanimoto score: 0.75
MMs03272583
tanimoto score: 0.75

MMs01150832
tanimoto score: 0.75
MMs01150831
tanimoto score: 0.75
MMs02392340
tanimoto score: 0.75
MMs00338268
tanimoto score: 0.74

MMs00034222
tanimoto score: 0.74
MMs01295608
tanimoto score: 0.74
MMs00338266
tanimoto score: 0.74
MMs00333341
tanimoto score: 0.74

MMs02457901
tanimoto score: 0.74
MMs01175354
tanimoto score: 0.74
MMs02457588
tanimoto score: 0.74
MMs02443118
tanimoto score: 0.74


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