| Compound ID | EN300-1706036_1 | 
| ΔG / kcal M-1 | −13.5 ± 0.8 | 
| IC50 / µM | TBD | 
| pIC50 | TBD | 
| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distributions | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN864 | MAT-POS-8a69d52e-7_1 |  | EN300-1706036_1_2 |  | 2.8 ± 0.8 |   |   | ||||