COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK417646
Chemical Name: (2E)-N-(butan-2-yl)-3-(4-nitrophenyl)prop-2-enamide
Smiles: CCC(NC(=O)/C=C/c1ccc(cc1)[N+](=O)[O-])C

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Molecular Weight: 248.28
Empirical Formula: C13H16N2O3

Physical State: Dry powder
Available Amount: 520 mg

Lipinsky:
logP: 2.639
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 74
Number of rings: 1

     

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