ADA-UCB-dc2b944c-1

molecule

Data

Compound ID ADA-UCB-dc2b944c-1
ΔG / kcal M-1 −15.5 ± 0.3
IC50 / µM TBD
pIC50 TBD

Transformations

RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distributions Convergence
RUN491 MAT-POS-b3e365b9-1_1 molecule ADA-UCB-dc2b944c-1_1 molecule −6.9 ± 0.4 work distributions convergence plot
RUN464 MAT-POS-b3e365b9-1_1 molecule ADA-UCB-dc2b944c-1_2 molecule −6.4 ± 0.3 work distributions convergence plot
Last updated 2021-01-31T08:31:34.705671+00:00
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