COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK699928
Chemical Name: benzyl4-({(2E)-3-[4-(acetyloxy)phenyl]-2-[(phenylcarbonyl)amino]prop-2-enoyl}amino)butanoate
Smiles: O=C(OCc1ccccc1)CCCNC(=O)/C(=C\c1ccc(cc1)OC(=O)C)/NC(=O)c1ccccc1

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Molecular Weight: 500.55
Empirical Formula: C29H28N2O6

Physical State: Dry powder
Available Amount: 255 mg

Lipinsky:
logP: 3.387
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 110
Number of rings: 3

     

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