Table 2. Binding Affinities and IC50 for Most Active Compounds.
| IC50 values (μg/mL) | IC50 values (μg/mL) | ||
|---|---|---|---|
| binding affinity (kcal/mol) | HCT-116 | MCF-7 | |
| 10b | –10.3 | 1.52 | 2.00 |
| 12b | –8.9 | 2.07 | 2.39 |
| 12c | –10.7 | 1.79 | 2.24 |
| 5 | –8.8 | 2.19 | 2.38 |
| 9f | –9.2 | 1.79 | 2.24 |
| crystallized inhibitor | –7.6 |