COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL002653
Chemical Name: 8-[(2E)-2-(3-bromo-4-hydroxy-5-methoxybenzylidene)hydrazinyl]-7-(2-hydroxyethyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCn1c(N/N=C/c2cc(Br)c(c(c2)OC)O)nc2c1c(=O)[nH]c(=O)n2C

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Molecular Weight: 453.25
Empirical Formula: C16H17BrN6O5

Available Amount: 0 mg

Lipinsky:
logP: 1.819
Rotatable bonds: 7
H-donors: 4
H-acceptors: 5
PSA: 141
Number of rings: 3

     

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