COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL058649
Chemical Name: {[6-hydroxy-3-methyl-2-oxo-7-(2-phenoxyethyl)-3,7-dihydro-2H-purin-8-yl]sulfanyl}acetate
Smiles: [O-]C(=O)CSc1nc2c(n1CCOc1ccccc1)c(O)nc(=O)n2C

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Saltdata: Na+
Molecular Weight: 375.39
Empirical Formula: C16H15N4O5S

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 1.835
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 145
Number of rings: 3

     

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