COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473347
Chemical Name: methyl(2E)-2-cyano-3-(3-ethoxy-4-{[3-(trifluoromethyl)benzyl]oxy}phenyl)prop-2-enoate
Smiles: CCOc1cc(ccc1OCc1cccc(c1)C(F)(F)F)/C=C(/C(=O)OC)\C#N

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Molecular Weight: 405.37
Empirical Formula: C21H18F3NO4

Physical State: Dry powder
Available Amount: 269 mg

Lipinsky:
logP: 4.414
Rotatable bonds: 8
H-donors: 0
H-acceptors: 4
PSA: 68
Number of rings: 2

     

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