COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK588039
Chemical Name: methylN-[(1-{N-[(4-methylphenyl)sulfonyl]-L-alanyl}piperidin-4-yl)carbonyl]-L-phenylalaninate
Smiles: COC(=O)[C@H](Cc1ccccc1)NC(=O)C1CCN(CC1)C(=O)[C@@H](NS(=O)(=O)c1ccc(cc1)C)C

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Saltdata: HCl
Molecular Weight: 515.63
Empirical Formula: C26H33N3O6S

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 2.781
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 130
Number of rings: 3

     

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