JAN-GHE-f4ca5a00-18

molecule

Data

Compound ID JAN-GHE-f4ca5a00-18
ΔG / kcal M-1 −12.1 ± 0.3
IC50 / µM TBD
pIC50 TBD

Transformations

RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distributions Convergence
RUN196 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-f4ca5a00-18_2 molecule −4.6 ± 0.3 work distributions convergence plot
RUN185 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-f4ca5a00-18_1 molecule −0.0 ± 0.2 work distributions convergence plot
Last updated 2021-06-18T01:04:04.984419+00:00
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