COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK847999
Chemical Name: 8-bromo-7-{2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]ethyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cc(C)nc(n1)SCCn1c(Br)nc2c1c(=O)n(C)c(=O)n2C

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Molecular Weight: 425.31
Empirical Formula: C15H17BrN6O2S

Physical State: Dry powder
Available Amount: 282 mg

Lipinsky:
logP: 3.503
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 109
Number of rings: 3

     

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