Table 5.
ADMET profile of hit compounds and reference drug
ADMET parameters | Capivasertib | Cynaroside | Epicatechin gallate |
---|---|---|---|
hERG Inhibition | 0.538 | 0.027 | 0.041 |
FDAMDD | 0.922 | 0.031 | 0.55 |
Lipinski rule | Accepted | Rejected | Accepted |
Pfizer rule | Accepted | Accepted | Accepted |
GSK rule | Rejected | Rejected | Rejected |
Golden triangle rule | Accepted | Accepted | Accepted |
BBB | 0.687 | 0.061 | 0.008 |
SAscore | 3.256 | 3.924 | 3.608 |
CL | 4.668 | 4.318 | 17.814 |
P-gp inhibitor | 0.01 | 0.001 | 0.024 |
Bioavailability | 0.55 | 0.17 | 0.55 |
Carcinogenicity | 0.233 | 0.569 | 0.042 |
Nephrotoxicity | 0.517 | 0.081 | 0.196 |