EN300-80230_1

molecule

Data

Compound ID EN300-80230_1
ΔG / kcal M-1 −10.0 ± 0.1
IC50 / µM TBD
pIC50 TBD

Transformations

RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distributions Convergence
RUN4590 MAT-POS-8a69d52e-7_1 molecule EN300-80230_1_1 molecule −3.2 ± 0.2 work distributions convergence plot
RUN4594 MAT-POS-8a69d52e-7_1 molecule EN300-80230_1_1 molecule −3.1 ± 0.2 work distributions convergence plot
Last updated 2020-12-05T16:15:48.767793+00:00
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