COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK545949
Chemical Name: 7-[2-(4-fluorophenyl)-2-oxoethyl]-1,3-dimethyl-8-(4-methylpiperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCN(CC1)c1nc2c(n1CC(=O)c1ccc(cc1)F)c(=O)n(c(=O)n2C)C

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Molecular Weight: 413.45
Empirical Formula: C21H24FN5O3

Physical State: Dry powder
Available Amount: 225 mg

Lipinsky:
logP: 2.886
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 78
Number of rings: 4

     

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