Table 6.
Prediction of the pharmacokinetic parameters and toxicity of isoliquiritigenin.
Compound | Drug-likeness | Lead-likeness | Log Po/wa | Solubilityb | HIAc | BBB permeabilityd | CNS permeabilitye | AMES toxicity | Hepatotoxicity |
---|---|---|---|---|---|---|---|---|---|
Isoliquiritigenin | Yes | Yes | 2.37 | − 3.06 | 91.096% | Yes (− 0.717) | − 2.205 | No | No |
aOctanol-water partition coefficient.
bLogS scale: Insoluble < − 10 < Poorly < − 6 < Moderately < − 4 < Soluble < − 2 < Very < 0 < Highly.
cHuman intestinal absorption: If < 30%, poorly absorbed.
dLog BB > 0.3 considered to readily cross the blood brain barrier, while log BB < − 1 considered to be poorly distributed to the brain.
eLog PS values > − 2 are considered to penetrate the CNS, while log PS values < − 3 are considered unable to penetrate the CNS.