Compound ID | EN300-196962_1 |
ΔG / kcal M-1 | −9.3 ± 0.5 |
IC50 / µM | TBD |
pIC50 | TBD |
RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distributions | Convergence | ||||
---|---|---|---|---|---|---|---|---|---|
RUN282 | MAT-POS-8a69d52e-7_1 |
|
EN300-196962_1_1 |
|
1.2 ± 0.5 |
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