JAN-GHE-83b26c96-7

molecule

Data

Compound ID JAN-GHE-83b26c96-7
ΔG / kcal M-1 −8.50 ± 0.10
IC50 / µM TBD
pIC50 TBD

Transformations

RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distributions Convergence
RUN22 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-83b26c96-7_1 molecule −1.0 ± 0.1 work distributions convergence plot
RUN30 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-83b26c96-7_2 molecule −0.1 ± 0.1 work distributions convergence plot
Last updated 2021-06-27T17:19:22.336941+00:00
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