COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK667363
Chemical Name: 8-{[(6-bromo-1,3-benzodioxol-5-yl)methyl]sulfanyl}-7-(2-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1cc2OCOc2cc1CSc1nc2c(n1Cc1ccccc1F)c(=O)n(c(=O)n2C)C

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Molecular Weight: 533.38
Empirical Formula: C22H18BrFN4O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.711
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 102
Number of rings: 5

     

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