COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK834350
Chemical Name: 7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-8-(methylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CSc1nc2c(n1CC(COc1ccccc1C)O)c(=O)[nH]c(=O)n2C

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Molecular Weight: 376.44
Empirical Formula: C17H20N4O4S

Physical State: Dry powder
Available Amount: 324 mg

Lipinsky:
logP: 2.495
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 121
Number of rings: 3

     

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