Table 3. Details of the Selected Lead-like Molecules and Orlistat in Descending Order of Their Binding Affinity Scores (in kcal/mol) Confirmed Through Docking Analysis.
| S. no | PubChem CID | Binding affinity (in kcal/mol) |
|---|---|---|
| 1 | 15515703 (Jujubogenin) | –9.0 |
| 2 | 51029223 (Amphibine H) | –8.5 |
| 3 | 44258335 (Spinosin-6111-(E)-P-coumarate) | –8.5 |
| 4 | 5373023 (Mucronine D) | –8.3 |
| 5 | 21597353 (6111-feruloylspinosin) | –8.1 |
| 6 | 5273923 (Ziziphine N) | –7.7 |
| 7 | Orlistat | –5.7 |