COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK228685
Chemical Name: 7-(4-bromobenzyl)-1,3-dimethyl-8-phenoxy-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1ccc(cc1)Cn1c(Oc2ccccc2)nc2c1c(=O)n(C)c(=O)n2C

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Molecular Weight: 441.28
Empirical Formula: C20H17BrN4O3

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 5.06
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 67
Number of rings: 4

     

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