COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK586165
Chemical Name: 7-(2-chlorobenzyl)-8-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccccc1N1CCN(CC1)Cc1nc2c(n1Cc1ccccc1Cl)c(=O)n(c(=O)n2C)C

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Molecular Weight: 496.97
Empirical Formula: C25H26ClFN6O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.786
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 64
Number of rings: 5

     

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