Table 3 Toxicity risks and physicochemical properties of oseltamivir and virtual compounds predicted by OSIRIS property explorer
S.No | Compound | Mutagenic | Tumorigenic | Irritant | cLogP | Solubility | Drug likeness | Drug score |
|---|---|---|---|---|---|---|---|---|
1 | Oseltamivir | No | No | No | 1.439 | -2.448 | -1.499 | 0.535 |
2 | Neoglucobrassicin | No | No | No | 0.175 | -4.006 | -0.046 | 0.558 |
3 | Epifriedelanol Acetate | No | No | No | 7.729 | -7.327 | -12.317 | 0.134 |
4 | g-strophanthin | No | No | No | 2.138 | -4.339 | -0.327 | 0.422 |
5 | Acanthoglabrolide | Medium | No | High | 4.405 | -4.187 | -12.317 | 0.134 |
6 | AllylPropyl disulfide | No | No | No | 0.888 | -2.767 | -5.032 | 0.471 |
7 | Allyl mono sulfide | No | No | No | 0.714 | -2.671 | -3.852 | 0.481 |
8 | Strictinin | No | No | No | 0.89 | -2.79 | -2.836 | 0.284 |
9 | Strophanthin | No | No | High | 1.105 | -3.79 | -3.276 | 0.239 |
10 | Acanthoside | No | No | No | 1.787 | -1.7 | -1.884 | 0.259 |