COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK527478
Chemical Name: 8-(butan-2-ylsulfanyl)-3-methyl-7-octyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCn1c(SC(CC)C)nc2c1c(=O)[nH]c(=O)n2C

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Molecular Weight: 366.53
Empirical Formula: C18H30N4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.76
Rotatable bonds: 10
H-donors: 1
H-acceptors: 2
PSA: 92
Number of rings: 2

     

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