Compound ID | EN300-124164_2 |
ΔG / kcal M-1 | −15.8 ± 0.4 |
IC50 / µM | TBD |
pIC50 | TBD |
RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distributions | Convergence | ||||||
---|---|---|---|---|---|---|---|---|---|---|---|
RUN10223 | MAT-POS-b3e365b9-1_1 |
|
EN300-124164_2_1 |
|
−6.3 ± 0.4 |
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