EN300-122656_1

molecule

Data

Compound ID EN300-122656_1
ΔG / kcal M-1 −13.6 ± 0.5
IC50 / µM TBD
pIC50 TBD

Transformations

RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distributions Convergence
RUN5073 MAT-POS-b3e365b9-1_1 molecule EN300-122656_1_2 molecule −4.6 ± 0.5 work distributions convergence plot
RUN5940 MAT-POS-b3e365b9-1_1 molecule EN300-122656_1_1 molecule −2.2 ± 0.4 work distributions convergence plot
Last updated 2021-02-11T07:27:27.453800+00:00
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