COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK533287
Chemical Name: (4aR,8aS)-1,4-bis[(4-nitrobenzyl)oxy]octahydroquinoxaline-2,3-dione
Smiles: O=C1N(OCc2ccc(cc2)[N+](=O)[O-])[C@@H]2CCCC[C@@H]2N(C1=O)OCc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 470.44
Empirical Formula: C22H22N4O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.139
Rotatable bonds: 2
H-donors: 0
H-acceptors: 8
PSA: 150
Number of rings: 4

     

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