COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK362087
Chemical Name: 3-[(1E)-3-{[2-chloro-5-(trifluoromethyl)phenyl]amino}-2-cyano-3-oxoprop-1-en-1-yl]phenyl4-methoxybenzoate
Smiles: COc1ccc(cc1)C(=O)Oc1cccc(c1)/C=C(/C(=O)Nc1cc(ccc1Cl)C(F)(F)F)\C#N

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Molecular Weight: 500.86
Empirical Formula: C25H16ClF3N2O4

Physical State: Dry powder
Available Amount: 271 mg

Lipinsky:
logP: 6.855
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 88
Number of rings: 3

     

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