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. Author manuscript; available in PMC: 2021 Sep 10.
Published in final edited form as: J Med Chem. 2020 Aug 13;63(17):9912–9927. doi: 10.1021/acs.jmedchem.0c01017

Table 7.

Summary table of compound NEU-4854 (4aa)

Parameters NEU-4854 (4aa)
T. b. brucei pEC50 6.9
MRC5 pTC50 4.3
cLogP 1.2
PSA 96
LLE 5.7
Thermodynamic Aqueous solubility (μM) 212
MW 312
LogD7.4 1.9
CNS MPO score 5.0
Human PPB (%) 72
HLM CLint (mL/min/mg) 17
Rat Hepatocyte CLint (mL/min/10×6) 2.3
Mouse Liver Microsome (CLint) (mL/min/g liver) 4.1
CYP3A4 Liability No
Mouse plasma stability Stable
Caco-2 permeability Permeable