COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL334430
Chemical Name: (2E)-N-(1-butyl-3-cyano-1H-pyrrolo[2,3-b]quinoxalin-2-yl)-3-(3-nitrophenyl)prop-2-enamide
Smiles: CCCCn1c2nc3ccccc3nc2c(c1NC(=O)/C=C/c1cccc(c1)[N+](=O)[O-])C#N

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Molecular Weight: 440.46
Empirical Formula: C24H20N6O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 7.389
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 129
Number of rings: 4

     

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