COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK841379
Chemical Name: 7-hexyl-3-methyl-8-[(2-methylprop-2-en-1-yl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCn1c(SCC(=C)C)nc2c1c(=O)[nH]c(=O)n2C

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Molecular Weight: 336.46
Empirical Formula: C16H24N4O2S

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 4.667
Rotatable bonds: 8
H-donors: 1
H-acceptors: 2
PSA: 92
Number of rings: 2

     

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