PET-UNK-1320d94d-1

molecule

Data

Compound ID PET-UNK-1320d94d-1
ΔG / kcal M-1 −9.1 ± 0.2
IC50 / µM TBD
pIC50 TBD

Transformations

RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distributions Convergence
RUN1526 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-1320d94d-1_1 molecule −1.5 ± 0.2 work distributions convergence plot
Last updated 2021-11-12T06:11:06.748777+00:00
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