COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL323544
Chemical Name: 3,7-dimethyl-8-[(3-methylbutyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCSc1nc2c(n1C)c(=O)[nH]c(=O)n2C)C

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Molecular Weight: 282.37
Empirical Formula: C12H18N4O2S

Physical State: Dry powder
Available Amount: 209 mg

Lipinsky:
logP: 2.571
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 92
Number of rings: 2

     

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