COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL038487
Chemical Name: 8-bromo-6-hydroxy-3-methyl-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3,7-dihydro-2H-purin-2-one
Smiles: Oc1nc(=O)n(c2c1n(CCSc1nnnn1c1ccccc1)c(n2)Br)C

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Molecular Weight: 449.29
Empirical Formula: C15H13BrN8O2S

Physical State: Dry powder
Available Amount: 289 mg

Lipinsky:
logP: 2.946
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 139
Number of rings: 4

     

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