COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL149536
Chemical Name: 8-(decylsulfanyl)-6-hydroxy-3-methyl-7-(prop-2-en-1-yl)-3,7-dihydro-2H-purin-2-one
Smiles: C=CCn1c(SCCCCCCCCCC)nc2c1c(O)nc(=O)n2C

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Molecular Weight: 378.54
Empirical Formula: C19H30N4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.89
Rotatable bonds: 13
H-donors: 1
H-acceptors: 2
PSA: 96
Number of rings: 2

     

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