COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL045738
Chemical Name: 6-hydroxy-3-methyl-7-nonyl-8-(pentylsulfanyl)-3,7-dihydro-2H-purin-2-one
Smiles: CCCCCCCCCn1c(SCCCCC)nc2c1c(O)nc(=O)n2C

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Molecular Weight: 394.58
Empirical Formula: C20H34N4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.656
Rotatable bonds: 14
H-donors: 1
H-acceptors: 2
PSA: 96
Number of rings: 2

     

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