COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL003112
Chemical Name: 8-{[benzyl(methyl)amino]methyl}-7-(2-chloro-6-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN(Cc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)n(c(=O)n2C)C)Cc1ccccc1

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Molecular Weight: 455.92
Empirical Formula: C23H23ClFN5O2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.166
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 61
Number of rings: 4

     

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