JAN-GHE-83b26c96-8

molecule

Data

Compound ID JAN-GHE-83b26c96-8
ΔG / kcal M-1 −6.18 ± 0.10
IC50 / µM TBD
pIC50 4.761694261068177

Transformations

RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distributions Convergence
RUN22 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-83b26c96-8_2 molecule 0.8 ± 0.4 work distributions convergence plot
RUN23 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-83b26c96-8_1 molecule 7.6 ± 0.3 work distributions convergence plot
Last updated 2021-07-29T00:38:39.498831+00:00
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