COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK087503
Chemical Name: methyl4-({(2E)-2-cyano-3-[3-ethoxy-4-hydroxy-5-(prop-2-en-1-yl)phenyl]prop-2-enoyl}amino)benzoate
Smiles: CCOc1cc(/C=C(/C(=O)Nc2ccc(cc2)C(=O)OC)\C#N)cc(c1O)CC=C

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Molecular Weight: 406.44
Empirical Formula: C23H22N2O5

Physical State: Dry powder
Available Amount: 109 mg

Lipinsky:
logP: 4.573
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 108
Number of rings: 2

     

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