COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK431432
Chemical Name: (2E)-2-cyano-3-(6,8-dichloro-4-oxo-4H-chromen-3-yl)-N-[3-(trifluoromethyl)phenyl]prop-2-enamide
Smiles: N#C/C(=C\c1coc2c(c1=O)cc(cc2Cl)Cl)/C(=O)Nc1cccc(c1)C(F)(F)F

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Molecular Weight: 453.2
Empirical Formula: C20H9Cl2F3N2O3

Physical State: Dry powder
Available Amount: 364 mg

Lipinsky:
logP: 4.115
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 79
Number of rings: 3

     

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