COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK096059
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-N-(2-methyl-4-nitrophenyl)prop-2-enamide
Smiles: O=C(Nc1ccc(cc1C)[N+](=O)[O-])/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 326.31
Empirical Formula: C17H14N2O5

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 4.772
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 93
Number of rings: 3

     

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