COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK734683
Chemical Name: 2,2-dimethyl-5,5-bis(4-nitrobenzyl)-1,3-dioxane-4,6-dione
Smiles: O=C1OC(C)(C)OC(=O)C1(Cc1ccc(cc1)[N+](=O)[O-])Cc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 414.37
Empirical Formula: C20H18N2O8

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.512
Rotatable bonds: 2
H-donors: 0
H-acceptors: 8
PSA: 144
Number of rings: 3

     

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