COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL322850
Chemical Name: 8-[(2E)-2-(5-bromo-2-hydroxybenzylidene)hydrazinyl]-3-methyl-7-pentyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCn1c(N/N=C/c2cc(Br)ccc2O)nc2c1c(=O)[nH]c(=O)n2C

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Molecular Weight: 449.31
Empirical Formula: C18H21BrN6O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.81
Rotatable bonds: 7
H-donors: 3
H-acceptors: 3
PSA: 111
Number of rings: 3

     

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