| Compound ID | EN300-10895_3 |
| ΔG / kcal M-1 | −9.5 ± 0.4 |
| IC50 / µM | TBD |
| pIC50 | TBD |
| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distributions | Convergence | ||||
|---|---|---|---|---|---|---|---|---|---|
| RUN411 | MAT-POS-8a69d52e-7_1 |
|
EN300-10895_3_1 |
|
1.5 ± 0.4 |
|
|
||