Predicted ADME profiles of the synthesized compounds.
| Compound | BBBa | GIT absorptionb | Solubilityc | CYP2D6d | Bioavailability scoree |
|---|---|---|---|---|---|
| 4 | Yes | High | −4.24 | Yes | 0.55 |
| 5 | Yes | High | −4.33 | No | 0.55 |
| 6 | Yes | High | −4.92 | No | 0.55 |
| Sach A | Yes | High | −4.57 | No | 0.55 |
a
Predicts ability of the compound to penetrate the blood brain barrier (BBB) according to the yolk of the boiled egg.
b
Predicts gastrointestinal absorption according to the white of the boiled egg.
c
Predicts the solubility of each compound in water. Levels <−10, <−6, <−4, <−2, <0 correspond to insoluble, poorly soluble, moderately soluble, soluble, very soluble, respectively.
d
Predicts the cytochrome P450, 2D6 inhibition.
e
Predicts the bioavailability score.