MMsINC Database Search
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Ligand PDB



ligand: ROC
Name: N~1~-{(1S,2R)-1-benzyl-3-[(3R,4aR,8aR)-3-(tert-butylcarbamoyl)octahydroisoquinolin-2(1H)-yl]-
2-hydroxypropyl}-N~2~-(quinolin-2-ylcarbonyl)-L-aspartamide
SMILES: CC(C)(C)NC(=O)C1CC2CCCCC2CN1CC(C
(Cc3ccccc3)NC(=O)C(CC(=O)N)NC(=O)c4ccc5ccccc5n4)O		[show PDB table]

MMsINC molecules which have a Tanimoto coefficient superior or equal to 0.70

Neutral Molecules: 27677Ionic States: 6388Tautomers: 789Drug Similarity: 15 Items found 21 - 40 of 27677 



of 1384    Go to Page   



MMs02248025
tanimoto score: 0.84
MMs02507283
tanimoto score: 0.84
MMs02310368
tanimoto score: 0.84
MMs03549442
tanimoto score: 0.84

MMs01667054
tanimoto score: 0.84
MMs02207308
tanimoto score: 0.84
MMs03384668
tanimoto score: 0.84
MMs02909920
tanimoto score: 0.84

MMs03199326
tanimoto score: 0.84
MMs02372331
tanimoto score: 0.84
MMs02909918
tanimoto score: 0.84
MMs03407659
tanimoto score: 0.84

MMs02516004
tanimoto score: 0.84
MMs02507296
tanimoto score: 0.84
MMs01379465
tanimoto score: 0.84
MMs02507298
tanimoto score: 0.84

MMs02507300
tanimoto score: 0.84
MMs02507302
tanimoto score: 0.84
MMs02865633
tanimoto score: 0.84
MMs01667056
tanimoto score: 0.84


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