COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK640970
Chemical Name: benzyl{[6-hydroxy-7-(2-methoxyethyl)-3-methyl-2-oxo-3,7-dihydro-2H-purin-8-yl]sulfanyl}acetate
Smiles: COCCn1c(SCC(=O)OCc2ccccc2)nc2c1c(O)nc(=O)n2C

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Molecular Weight: 404.45
Empirical Formula: C18H20N4O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.238
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 131
Number of rings: 3

     

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