COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL341005
Chemical Name: 8-[benzyl(methyl)amino]-7-(2-chloro-6-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1cccc(c1Cn1c(nc2c1c(=O)n(c(=O)n2C)C)N(Cc1ccccc1)C)Cl

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Molecular Weight: 441.89
Empirical Formula: C22H21ClFN5O2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.851
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 61
Number of rings: 4

     

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