EN300-1600517_4

molecule

Data

Compound ID EN300-1600517_4
ΔG / kcal M-1 −13.7 ± 0.3
IC50 / µM TBD
pIC50 TBD

Transformations

RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distributions Convergence
RUN389 MAT-POS-8a69d52e-7_1 molecule EN300-1600517_4_2 molecule −1.8 ± 0.4 work distributions convergence plot
RUN453 MAT-POS-8a69d52e-7_1 molecule EN300-1600517_4_1 molecule −0.5 ± 0.3 work distributions convergence plot
Last updated 2020-11-10T19:30:20.028854+00:00
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