Table 3.
ADMET profile for compound 18.
| Parameter | Value |
|---|---|
| Aqueous solubility (PBS, pH 7.4) at 2.0 × 10−4 m: | 31.8 ± 1.8 μm |
| Protein bound (human): | 82.8 ± 11.1 % |
| Protein recovery (human): | 95.6 ± 13.6 % |
| A–B permeability (TC7, pH 6.5/7.4) [10−6 cm s−1]: | 52.2 ± 1.7 |
| A–B permeability (% recovery): | 63.5 ± 6.5 % |
| B–A permeability (TC7, pH 6.5/7.4) [10−6 cm s−1]: | 16.2 ± 0.2 |
| B–A permeability (% recovery): | 85.5 ± 0.5 % |
| Ames test (strain TA98): | <0 |
| Ames test (strain TA98 +S9): | <0 |
| K+ channel hERG automated patch-clamp (cardiac toxicity): | inactive at 1 μm |