COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK773550
Chemical Name: 8-(4-butanoylphenoxy)-7-(2-chloro-6-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCC(=O)c1ccc(cc1)Oc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)n(c(=O)n2C)C

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Molecular Weight: 484.91
Empirical Formula: C24H22ClFN4O4

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.255
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 84
Number of rings: 4

     

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