EN300-77778_1

molecule

Data

Compound ID EN300-77778_1
ΔG / kcal M-1 −10.1 ± 0.3
IC50 / µM TBD
pIC50 TBD

Transformations

RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distributions Convergence
RUN2930 MAT-POS-8a69d52e-7_1 molecule EN300-77778_1_2 molecule −3.2 ± 0.3 work distributions convergence plot
Last updated 2020-11-26T23:00:54.054000+00:00
Generated by fah-xchem version 0.1.0+23.g1c2d7b9