COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK762045
Chemical Name: 8-(dodecylsulfanyl)-7-(2-methoxyethyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCSc1nc2c(n1CCOC)c(=O)[nH]c(=O)n2C

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Molecular Weight: 424.61
Empirical Formula: C21H36N4O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.485
Rotatable bonds: 15
H-donors: 1
H-acceptors: 3
PSA: 101
Number of rings: 2

     

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