COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK033349
Chemical Name: 8-(dodecylsulfanyl)-7-heptyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCSc1nc2c(n1CCCCCCC)c(=O)[nH]c(=O)n2C

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Molecular Weight: 464.72
Empirical Formula: C25H44N4O2S

Physical State: Dry powder
Available Amount: 402 mg

Lipinsky:
logP: 9.663
Rotatable bonds: 18
H-donors: 1
H-acceptors: 2
PSA: 92
Number of rings: 2

     

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