COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK067147
Chemical Name: (2Z)-3-{3-bromo-4-[(3-chlorobenzyl)oxy]-5-ethoxyphenyl}-2-cyano-N-(2,4-dimethylphenyl)prop-2-enamide
Smiles: CCOc1cc(/C=C(\C(=O)Nc2ccc(cc2C)C)/C#N)cc(c1OCc1cccc(c1)Cl)Br

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Molecular Weight: 539.86
Empirical Formula: C27H24BrClN2O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.666
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 71
Number of rings: 3

     

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