Table 7 Detailed toxicity analysis by pkCSM.
Compounds | Toxicity | ||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
Renal OCT2 substrate (Yes/No) | AMES toxicity (Yes/No) | Max tolerated dose (human) (log mg/kg/day) | hERG I inhibitor (Yes/No) | hERG II inhibitor (Yes/No) | Oral rat acute toxicity (LD50) (mol/kg) | Oral Rat Chronic Toxicity (LOAEL) (log mg/kg_bw/day) | Hepatotoxicity (Yes/No) | Skin Sensitisation (Yes/No) | T. Pyriformis toxicity (log μg/L) | Minnow toxicity (log mM) | |
Djh1 | No | No | 0.111 | No | Yes | 2.594 | 1.38 | Yes | No | 0.294 | −0.016 |
10 | No | No | 0.287 | No | Yes | 2.303 | 1.469 | Yes | No | 0.289 | 0.01 |
06 | No | No | 0.098 | No | Yes | 2.591 | 1.356 | Yes | No | 0.299 | 0.172 |
Dhj2 | No | Yes | 0.147 | No | Yes | 2.78 | 1.899 | Yes | No | 0.304 | 2.2 |
08 | No | Yes | −0.3 | No | Yes | 2.895 | 1.286 | Yes | No | 0.292 | 3.35 |
19 | No | Yes | 0.433 | No | Yes | 2.798 | 1.296 | Yes | No | 0.286 | 2.746 |
Inavolisib | No | Yes | 0.044 | No | Yes | 2.507 | 1.269 | Yes | No | 0.285 | 2.434 |
