COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK573810
Chemical Name: 7-(2-hydroxy-2-phenylethyl)-1,3-dimethyl-8-(4-methylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN1CCN(CC1)c1nc2c(n1CC(c1ccccc1)O)c(=O)n(c(=O)n2C)C

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Molecular Weight: 398.47
Empirical Formula: C20H26N6O3

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 0.959
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 85
Number of rings: 4

     

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