COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK700067
Chemical Name: 8-bromo-7-(2-chlorobenzyl)-3-methyl-1-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cccc(c1)Cn1c(=O)c2n(Cc3ccccc3Cl)c(nc2n(c1=O)C)Br

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Molecular Weight: 473.76
Empirical Formula: C21H18BrClN4O2

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 6.089
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 58
Number of rings: 4

     

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