COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK838397
Chemical Name: 8-(ethylsulfanyl)-1,3-dimethyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: C=CCn1c(SCC)nc2c1c(=O)n(c(=O)n2C)C

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Molecular Weight: 280.35
Empirical Formula: C12H16N4O2S

Physical State: Dry powder
Available Amount: 247 mg

Lipinsky:
logP: 2.699
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 83
Number of rings: 2

     

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