DAR-DIA-23e5a6a0-9

molecule

Data

Compound ID DAR-DIA-23e5a6a0-9
ΔG / kcal M-1 −13.3 ± 0.4
IC50 / µM TBD
pIC50 TBD

Transformations

RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distributions Convergence
RUN188 MAT-POS-8a69d52e-7_1 molecule DAR-DIA-23e5a6a0-9_1 molecule −0.4 ± 0.7 work distributions convergence plot
RUN192 MAT-POS-8a69d52e-7_1 molecule DAR-DIA-23e5a6a0-9_2 molecule 2.7 ± 0.4 work distributions convergence plot
Last updated 2020-11-08T21:40:42.745696+00:00
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