EN300-25960_1_1

molecule

Data

Compound ID EN300-25960_1_1
ΔG / kcal M-1 −12.6 ± 0.4
IC50 / µM TBD
pIC50 TBD

Transformations

RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distributions Convergence
RUN3171 MAT-POS-b3e365b9-1_1 molecule EN300-25960_1_1_1 molecule −3.7 ± 0.4 work distributions convergence plot
Last updated 2021-01-31T08:31:34.705671+00:00
Generated by fah-xchem version 0.1.0+76.g1a4d290.dirty