EN300-72211_1

molecule

Data

Compound ID EN300-72211_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
RUN2922 MAT-POS-8a69d52e-7_1 molecule EN300-72211_1_1 molecule −3.1 ± 0.3 work distributions convergence plot
Last updated 2020-11-26T18:35:43.906337+00:00
Generated by fah-xchem version 0.1.0+21.gcd89c25.dirty