COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK734421
Chemical Name: 1'-{[benzyl(methyl)amino]methyl}-5-bromo-5-nitrospiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one
Smiles: CN(CN1c2ccccc2C2(C1=O)OCC(CO2)(Br)[N+](=O)[O-])Cc1ccccc1

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Molecular Weight: 462.3
Empirical Formula: C20H20BrN3O5

Physical State: Dry powder
Available Amount: 65 mg

Lipinsky:
logP: 6.596
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 87
Number of rings: 4

     

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