Table 3.
Docking model of the common active ingredients of CSTRG with MAPK14 protein.
| Mol ID | Compound | Formula | MW (g/mol) | OB (%) | DL index | 3CLpro (kcal/mol) |
|---|---|---|---|---|---|---|
| MOL000006 | Luteolin | C15H10O6 | 286.250 | 36.163 | 0.246 | −7.903 |
| MOL000098 | Quercetin | C15H10O7 | 302.250 | 46.433 | 0.275 | −8.037 |
| MOL000358 | Beta-sitosterol | C30H52O | 414.790 | 36.914 | 0.751 | −9.376 |
| MOL000359 | Sitosterol | C29H50O | 414.790 | 36.914 | 0.751 | −9.376 |
| MOL000422 | Kaempferol | C15H10O6 | 286.250 | 41.882 | 0.241 | −7.474 |
| MOL000449 | Stigmasterol | C29H48O | 412.770 | 43.830 | 0.757 | −9.573 |