COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK186468
Chemical Name: (2Z)-3-{3-bromo-4-[(4-fluorobenzyl)oxy]phenyl}-2-cyano-N-(3-ethoxyphenyl)prop-2-enamide
Smiles: CCOc1cccc(c1)NC(=O)/C(=C\c1ccc(c(c1)Br)OCc1ccc(cc1)F)/C#N

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Molecular Weight: 495.35
Empirical Formula: C25H20BrFN2O3

Physical State: Dry powder
Available Amount: 198 mg

Lipinsky:
logP: 6.46
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 71
Number of rings: 3

     

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