Table 3.
Drug likeness prediction of 11 active phytocompounds of 8 medicinal plants.
| Phytocompounds | miLogP | TPSA | MW | nON | nOHNH | Nviolations |
|---|---|---|---|---|---|---|
| Chenodeoxycholic acid | 4.25 | 77.75 | 392.28 | 4 | 3 | 0 |
| Asiaticoside | 0.37 | 315.21 | 959.13 | 19 | 12 | 3 |
| Beta-sitosterol | 8.62 | 20.23 | 414.72 | 1 | 1 | 1 |
| Bryophyllin A | 2.09 | 115.44 | 472.53 | 8 | 2 | 0 |
| Madecassoside | −0.55 | 335.44 | 975.13 | 20 | 13 | 3 |
| Mahanimbine | 7.10 | 25.02 | 331.46 | 2 | 1 | 1 |
| Pennogenin | 4.99 | 58.92 | 430.63 | 4 | 2 | 0 |
| Rutin | −1.06 | 269.43 | 610.52 | 16 | 10 | 3 |
| Solasonine | 1.40 | 258.72 | 884.07 | 17 | 10 | 3 |
| Solamargine | 2.41 | 238.49 | 868.07 | 16 | 9 | 3 |
| Withaferin A | 3.86 | 96.36 | 470.61 | 6 | 2 | 0 |
| Withanone | 4.15 | 96.36 | 470.61 | 6 | 2 | 0 |
miLogP—Molinspiration LogP (To measure lipophilicity), TPSA—topological polar surface area, MW—Molecular wait, nON—hydrogenbonds acceptor, nOHNH—hydrogen bonds donors, nviolations—Number of violations.