COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK838943
Chemical Name: 1,3-dimethyl-7-(3-methylbenzyl)-8-(4-phenylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cccc(c1)Cn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCN(CC1)c1ccccc1

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Molecular Weight: 444.54
Empirical Formula: C25H28N6O2

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 3.295
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 64
Number of rings: 5

     

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