VLA-UCB-1dbca3b4-17

molecule

Data

Compound ID VLA-UCB-1dbca3b4-17
ΔG / kcal M-1 −11.7 ± 0.4
IC50 / µM TBD
pIC50 TBD

Transformations

RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distributions Convergence
RUN166 PET-UNK-29afea89-2_1 molecule VLA-UCB-1dbca3b4-17_1 molecule −5.4 ± 0.4 work distributions convergence plot
RUN167 PET-UNK-29afea89-2_1 molecule VLA-UCB-1dbca3b4-17_2 molecule −1.7 ± 0.3 work distributions convergence plot
Last updated 2021-06-04T18:13:56.580002+00:00
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