COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL322287
Chemical Name: 7-[2-(benzylamino)ethyl]-8-bromo-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)n(c2c1n(CCNCc1ccccc1)c(n2)Br)C

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Molecular Weight: 378.23
Empirical Formula: C15H16BrN5O2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.478
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 79
Number of rings: 3

     

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