MMsINC Database Search
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Ligand PDB



ligand: A70
Name: N-ethyl-N-[(4-methylpiperazin-1-yl)carbonyl]-D-phenylalanyl-N-[(1S,2S,4R)-4-(butylcarbamoyl)-
1-(cyclohexylmethyl)-2-hydroxy-5-methylhexyl]-L-norleucinamide
SMILES: CCCCC(C(=O)NC(CC1CCCCC1)C(CC(
C(C)C)C(=O)NCCCC)O)N2CCN(C(C2=O)Cc3ccccc3)C(=O)N4CCN(CC4)C
[show PDB table]


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

Neutral Molecules: 7609Ionic States: 3133Tautomers: 224Drug Similarity: 36 Items found 1 - 20 of 7609 



of 381    Go to Page   



MMs03463451
tanimoto score: 0.84

MMs03076318
tanimoto score: 0.84

MMs03076320
tanimoto score: 0.83

MMs00447498
tanimoto score: 0.82

MMs00447496
tanimoto score: 0.82

MMs00447500
tanimoto score: 0.82

MMs00345133
tanimoto score: 0.82

MMs00472499
tanimoto score: 0.82

MMs00345135
tanimoto score: 0.82

MMs03643395
tanimoto score: 0.81

MMs03034438
tanimoto score: 0.81

MMs03643391
tanimoto score: 0.81

MMs01851809
tanimoto score: 0.81

MMs00468434
tanimoto score: 0.81

MMs00464556
tanimoto score: 0.81

MMs00468430
tanimoto score: 0.81

MMs00447598
tanimoto score: 0.81

MMs00468432
tanimoto score: 0.81

MMs03651624
tanimoto score: 0.81

MMs03651623
tanimoto score: 0.81


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