JAN-GHE-f4ca5a00-19

molecule

Data

Compound ID JAN-GHE-f4ca5a00-19
ΔG / kcal M-1 −9.0 ± 0.2
IC50 / µM TBD
pIC50 TBD

Transformations

RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distributions Convergence
RUN936 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-f4ca5a00-19_2 molecule −1.7 ± 0.2 work distributions convergence plot
RUN940 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-f4ca5a00-19_1 molecule 0.0 ± 0.2 work distributions convergence plot
Last updated 2021-06-26T16:53:57.819419+00:00
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