COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK522707
Chemical Name: 4-[(1E)-2-cyano-3-oxo-3-{[2-(trifluoromethyl)phenyl]amino}prop-1-en-1-yl]phenyl4-methylbenzoate
Smiles: N#C/C(=C\c1ccc(cc1)OC(=O)c1ccc(cc1)C)/C(=O)Nc1ccccc1C(F)(F)F

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Molecular Weight: 450.42
Empirical Formula: C25H17F3N2O3

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 6.408
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 79
Number of rings: 3

     

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