EN300-261986_1

molecule

Data

Compound ID EN300-261986_1
ΔG / kcal M-1 −11.3 ± 0.5
IC50 / µM TBD
pIC50 TBD

Transformations

RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distributions Convergence
RUN524 MAT-POS-b3e365b9-1_1 molecule EN300-261986_1_1 molecule −3.0 ± 0.4 work distributions convergence plot
RUN516 MAT-POS-b3e365b9-1_1 molecule EN300-261986_1_1 molecule −3.0 ± 0.7 work distributions convergence plot
Last updated 2021-01-23T04:52:59.212565+00:00
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