COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK538010
Chemical Name: 1,3-dimethyl-7-(2-methylprop-2-en-1-yl)-8-(nonylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCSc1nc2c(n1CC(=C)C)c(=O)n(c(=O)n2C)C

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Molecular Weight: 392.57
Empirical Formula: C20H32N4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.971
Rotatable bonds: 11
H-donors: 0
H-acceptors: 2
PSA: 83
Number of rings: 2

     

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