COVID Moonshot Sprint 5
Summary
Compounds
(current)
Microstates
Transformations
Reliable transformations
Retrospective transformations
EDJ-MED-6864a934-10
Data
Compound ID
EDJ-MED-6864a934-10
ΔG / kcal M
-1
−12.5
± 0.3
IC50 / µM
TBD
pIC50
TBD
Transformations
RUN
Initial microstate
Final microstate
ΔΔG / kcal M
-1
Work distributions
Convergence
RUN2454
MAT-POS-b3e365b9-1_1
sdf
pdb
EDJ-MED-6864a934-10_1
sdf
pdb
−3.7
± 0.2
Last updated 2021-01-31T08:31:34.705671+00:00
Generated by
fah-xchem
version 0.1.0+76.g1a4d290.dirty