COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL000798
Chemical Name: 8-[(2E)-2-(3-bromo-4-hydroxy-5-methoxybenzylidene)hydrazinyl]-1,3-dimethyl-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1cc(/C=N/Nc2nc3c(n2CC(=C)C)c(=O)n(c(=O)n3C)C)cc(c1O)Br

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Molecular Weight: 477.32
Empirical Formula: C19H21BrN6O4

Available Amount: 0 mg

Lipinsky:
logP: 4.536
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 112
Number of rings: 3

     

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