COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK381420
Chemical Name: (2E)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-(2-nitrophenyl)prop-2-enamide
Smiles: N#C/C(=C\c1ccccc1[N+](=O)[O-])/C(=O)Nc1cc(ccc1Cl)C(F)(F)F

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Molecular Weight: 395.72
Empirical Formula: C17H9ClF3N3O3

Physical State: Dry powder
Available Amount: 167 mg

Lipinsky:
logP: 4.867
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 98
Number of rings: 2

     

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