COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK390612
Chemical Name: (2E)-3-(3-nitrophenyl)-N-{[3-(trifluoromethyl)phenyl]carbamothioyl}prop-2-enamide
Smiles: O=C(NC(=S)Nc1cccc(c1)C(F)(F)F)/C=C/c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 395.36
Empirical Formula: C17H12F3N3O3S

Physical State: Dry powder
Available Amount: 198 mg

Lipinsky:
logP: 5.047
Rotatable bonds: 2
H-donors: 2
H-acceptors: 3
PSA: 119
Number of rings: 2

     

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