COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL028715
Chemical Name: 8-bromo-3-methyl-7-(2-oxo-2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=C(c1ccccc1)Cn1c(Br)nc2c1c(=O)[nH]c(=O)n2C

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Molecular Weight: 363.17
Empirical Formula: C14H11BrN4O3

Physical State: Dry powder
Available Amount: 1015 mg

Lipinsky:
logP: 2.249
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 84
Number of rings: 3

     

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