COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL341222
Chemical Name: 8-bromo-1,3-dimethyl-7-{2-[(4-methylpyrimidin-2-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccnc(n1)SCCn1c(Br)nc2c1c(=O)n(C)c(=O)n2C

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Molecular Weight: 411.28
Empirical Formula: C14H15BrN6O2S

Physical State: Dry powder
Available Amount: 323 mg

Lipinsky:
logP: 3.043
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 109
Number of rings: 3

     

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