COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL328760
Chemical Name: 8-[(2E)-2-(3-bromo-4-hydroxy-5-methoxybenzylidene)hydrazinyl]-1,3-dimethyl-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCn1c(N/N=C/c2cc(Br)c(c(c2)OC)O)nc2c1c(=O)n(c(=O)n2C)C

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Molecular Weight: 465.31
Empirical Formula: C18H21BrN6O4

Physical State: Dry powder
Available Amount: 89 mg

Lipinsky:
logP: 4.219
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 112
Number of rings: 3

     

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