Table 3.
Docking score of compounds in Rubus rosifolius leaves extract
| Compounds | Docking score | R (Kal.K-1.mol-1) | T (K) | Ln Ki | Ki |
|---|---|---|---|---|---|
| 2-(2-Hydroxy-cyclopentyl)pent-4-enal* | -64.1639 | 1.986 | 298 | -0.108416466 | 0.8973 |
| Quercetin** | -67.9795 | 1.986 | 298 | -0.114863609 | 0.8915 |
| Gallic acid | -64.1808 | 1.986 | 298 | -0.108445021 | 0.8972 |
| Tormentic acid | -62.9768 | 1.986 | 298 | -0.106410646 | 0.8991 |
| Pomolic acid | -62.1858 | 1.986 | 298 | -0.105074109 | 0.9003 |
| Euscaphic acid | -62.9795 | 1.986 | 298 | -0.106415208 | 0.8991 |
| Ellagic acid | -70.8865 | 1.986 | 298 | -0.119775509 | 0.8871 |
| Rosifoliol | -66.1917 | 1.986 | 298 | -0.111842799 | 0.8942 |
| Β-Caryophyllene | -52.7913 | 1.986 | 298 | -0.08920041 | 0.9147 |
| Trimethoxyflavonol | -63.0357 | 1.986 | 298 | -0.106510168 | 0.8990 |
| Pentamethoxyflavonol | -44.0313 | 1.986 | 298 | -0.074398812 | 0.9283 |
| Dihydroagarofuran | -56.2801 | 1.986 | 298 | -0.095095366 | 0.9093 |
*Reference ligand, **control positive