COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK848875
Chemical Name: 1,3-dimethyl-8-(3-methylpiperidin-1-yl)-7-[2-(pyrimidin-2-ylsulfanyl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCCN(C1)c1nc2c(n1CCSc1ncccn1)c(=O)n(c(=O)n2C)C

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Molecular Weight: 415.52
Empirical Formula: C19H25N7O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.454
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 112
Number of rings: 4

     

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