COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK069634
Chemical Name: 7-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccccc1N1CCN(CC1)C(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C

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Molecular Weight: 412.45
Empirical Formula: C20H24N6O4

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 0.736
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 91
Number of rings: 4

     

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