COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK762040
Chemical Name: 7-[(2E)-but-2-en-1-yl]-8-(ethylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCSc1nc2c(n1C/C=C/C)c(=O)[nH]c(=O)n2C

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Molecular Weight: 280.35
Empirical Formula: C12H16N4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.512
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 92
Number of rings: 2

     

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