MAT-POS-a13804f0-4

molecule

Data

Compound ID MAT-POS-a13804f0-4
ΔG / kcal M-1 −8.35 ± 0.07
IC50 / µM TBD
pIC50 6.345880067489219

Transformations

RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distributions Convergence
RUN1419 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-a13804f0-4_1 molecule −1.2 ± 0.2 work distributions convergence plot
RUN1423 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-a13804f0-4_2 molecule −0.8 ± 0.2 work distributions convergence plot
Last updated 2021-11-12T06:11:06.748777+00:00
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