Table 6. ADMET profile (Regression).
| Virtual Screened Drug: CID122677576 | Established Drug | |||
| Model Absorption | Value | Unit | Value | Unit |
| Aqueous solubility | -3.643 | LogS | -3.0651 | LogS |
| Caco-2 Permeability | 0.0081 | LogPapp,cm/s | -0.3591 | LogPapp,cm/s |
| Distribution | ||||
| Metabolism | ||||
| Excretion | ||||
| Toxicity | ||||
| Rat Acute Toxicity | 2.6698 | LD50,mol/kg | 3.4955 | LD50,mol/kg |
| Fish Toxicity | 1.6179 | pLC50,mg/L | 1.82 | pLC50,mg/L |
| Tetrahymena Pyriformis Toxicity | 0.3464 | pIGC50,ug/L | 0.2833 | pIGC50,ug/L |