COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK771221
Chemical Name: 8-[(3,4-diethoxybenzyl)sulfanyl]-7-(2-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCOc1cc(CSc2nc3c(n2Cc2ccccc2F)c(=O)n(c(=O)n3C)C)ccc1OCC

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Molecular Weight: 498.58
Empirical Formula: C25H27FN4O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.745
Rotatable bonds: 9
H-donors: 0
H-acceptors: 4
PSA: 102
Number of rings: 4

     

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