COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK362085
Chemical Name: (2E)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-{3-ethoxy-4-[(4-fluorobenzyl)oxy]phenyl}prop-2-enamide
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)F)/C=C(/C(=O)Nc1cc(ccc1Cl)C(F)(F)F)\C#N

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Molecular Weight: 518.89
Empirical Formula: C26H19ClF4N2O3

Physical State: Dry powder
Available Amount: 334 mg

Lipinsky:
logP: 7.382
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 71
Number of rings: 3

     

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