COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL322381
Chemical Name: 8-bromo-7-[2-hydroxy-3-(2-methoxyphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccccc1OCC(Cn1c(Br)nc2c1c(=O)[nH]c(=O)n2C)O

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Molecular Weight: 425.24
Empirical Formula: C16H17BrN4O5

Available Amount: 0 mg

Lipinsky:
logP: 1.998
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 105
Number of rings: 3

     

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