COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK581476
Chemical Name: 8-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(2-oxo-2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=C(c1ccccc1)Cn1c(CN2CCN(CC2)c2ccccc2F)nc2c1c(=O)n(c(=O)n2C)C

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Molecular Weight: 490.54
Empirical Formula: C26H27FN6O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.993
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 81
Number of rings: 5

     

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