COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK039722
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-N-(4-fluoro-3-nitrophenyl)prop-2-enamide
Smiles: O=C(Nc1ccc(c(c1)[N+](=O)[O-])F)/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 330.27
Empirical Formula: C16H11FN2O5

Physical State: Dry powder
Available Amount: 130 mg

Lipinsky:
logP: 4.378
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 93
Number of rings: 3

     

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