COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL553998
Chemical Name: (2E)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-[4-(prop-2-yn-1-yloxy)phenyl]prop-2-enamide
Smiles: C#CCOc1ccc(cc1)/C=C(/C(=O)Nc1cc(ccc1Cl)C(F)(F)F)\C#N

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Molecular Weight: 404.78
Empirical Formula: C20H12ClF3N2O2

Physical State: Dry powder
Available Amount: 1990 mg

Lipinsky:
logP: 5.3
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 62
Number of rings: 2

     

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