COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK541223
Chemical Name: methyl[(1,3-dimethyl-2,6-dioxo-7-pentyl-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetate
Smiles: CCCCCn1c(SCC(=O)OC)nc2c1c(=O)n(c(=O)n2C)C

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Molecular Weight: 354.43
Empirical Formula: C15H22N4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.566
Rotatable bonds: 8
H-donors: 0
H-acceptors: 4
PSA: 110
Number of rings: 2

     

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