COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK182387
Chemical Name: (2Z)-3-{4-[(4-bromobenzyl)oxy]-3-chloro-5-ethoxyphenyl}-2-cyano-N-(4-ethoxyphenyl)prop-2-enamide
Smiles: CCOc1cc(/C=C(\C(=O)Nc2ccc(cc2)OCC)/C#N)cc(c1OCc1ccc(cc1)Br)Cl

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Molecular Weight: 555.86
Empirical Formula: C27H24BrClN2O4

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 7.438
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 80
Number of rings: 3

     

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