COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK022779
Chemical Name: 7-(2-chloro-6-fluorobenzyl)-8-(2,5-dimethylphenoxy)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccc(c(c1)Oc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)n(c(=O)n2C)C)C

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Molecular Weight: 442.88
Empirical Formula: C22H20ClFN4O3

Physical State: Dry powder
Available Amount: 364 mg

Lipinsky:
logP: 5.414
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 67
Number of rings: 4

     

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