Table 1.
Docking scores for compound 2 and higher affinity compounds
| Compound | MMGBSA(kcal/mol) | Gscore(kcal/mol) |
|---|---|---|
| 2 | −44.6 | −8.1 |
| 6c | −42.1 | −8.6 |
| 13 | −41.3 | −7.1 |
| 17 | −40.4 | −7.9 |
Docking scores for compound 2 and higher affinity compounds
| Compound | MMGBSA(kcal/mol) | Gscore(kcal/mol) |
|---|---|---|
| 2 | −44.6 | −8.1 |
| 6c | −42.1 | −8.6 |
| 13 | −41.3 | −7.1 |
| 17 | −40.4 | −7.9 |