EN300-226314_1

molecule

Data

Compound ID EN300-226314_1
ΔG / kcal M-1 −10.5 ± 0.3
IC50 / µM TBD
pIC50 TBD

Transformations

RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distributions Convergence
RUN277 MAT-POS-b3e365b9-1_1 molecule EN300-226314_1_2 molecule −1.3 ± 0.4 work distributions convergence plot
RUN285 MAT-POS-b3e365b9-1_1 molecule EN300-226314_1_1 molecule −0.5 ± 0.4 work distributions convergence plot
Last updated 2020-12-15T05:03:16.328899+00:00
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