COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK011007
Chemical Name: 1-(2-chloro-6-fluorobenzyl)-8-(4-ethylphenoxy)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCc1ccc(cc1)Oc1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1c(F)cccc1Cl

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Molecular Weight: 442.88
Empirical Formula: C22H20ClFN4O3

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 5.486
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 67
Number of rings: 4

     

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