COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK447542
Chemical Name: (2E)-N-(heptan-2-yl)-3-(4-nitrophenyl)prop-2-enamide
Smiles: CCCCCC(NC(=O)/C=C/c1ccc(cc1)[N+](=O)[O-])C

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Molecular Weight: 290.36
Empirical Formula: C16H22N2O3

Physical State: Dry powder
Available Amount: 86 mg

Lipinsky:
logP: 4.233
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 74
Number of rings: 1

     

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