COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK839841
Chemical Name: 7-(4-fluorobenzyl)-3-methyl-8-nitro-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccc(cc1)Cn1c(nc2c1c(=O)[nH]c(=O)n2C)[N+](=O)[O-]

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Molecular Weight: 319.25
Empirical Formula: C13H10FN5O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.058
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 113
Number of rings: 3

     

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