ALP-POS-90e38439-3

molecule

Data

Compound ID ALP-POS-90e38439-3
ΔG / kcal M-1 −8.6 ± 0.4
IC50 / µM TBD
pIC50 TBD

Transformations

RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distributions Convergence
RUN990 ADA-UCB-6c2cb422-1_1 molecule ALP-POS-90e38439-3_2 molecule −0.2 ± 0.4 work distributions convergence plot
RUN987 ADA-UCB-6c2cb422-1_1 molecule ALP-POS-90e38439-3_1 molecule 2.1 ± 0.3 work distributions convergence plot
Last updated 2021-06-17T05:21:29.135352+00:00
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