COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK543993
Chemical Name: (2E)-3-(4-fluorophenyl)-N-[(2-nitrophenyl)carbamothioyl]prop-2-enamide
Smiles: S=C(Nc1ccccc1[N+](=O)[O-])NC(=O)/C=C/c1ccc(cc1)F

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Molecular Weight: 345.35
Empirical Formula: C16H12FN3O3S

Physical State: Dry powder
Available Amount: 259 mg

Lipinsky:
logP: 4.055
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 119
Number of rings: 2

     

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