Abraham, M. H.; Ibrahim, A.; Zhao, Y.; Acree, W. E. A data base for partition of volatile organic compounds and drugs from blood/plasma/serum to brain, and an LFER analysis of the data. J. Pharm. Sci. 2006, 95, 10, 2091–2100.

Compound

	ID:	255
	Name:	S-Etodolac
	Description:
	Labels:	Plasma, in_vivo
	CAS:
	InChi Code:	InChI=1S/C17H21NO3/c1-3-11-6-5-7-12-13-8-9-21-17(4-2,10-14(19)20)16(13)18-15(11)12/h5-7,18H,3-4,8-10H2,1-2H3,(H,19,20)

Properties

logBB: Blood-brain distribution

Value	Source or prediction
-1.34	experimental value
-1.616	Eq2: Model for drug-like chemicals, in vivo (Training set)
-1.6118	Eq5: Model for all chemicals, in vivo and in vitro (Training set)