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:	226
	Name:	Phencyclidine
	Description:
	Labels:	Serum, in_vivo
	CAS:
	InChi Code:	InChI=1S/C17H25N/c1-4-10-16(11-5-1)17(12-6-2-7-13-17)18-14-8-3-9-15-18/h1,4-5,10-11H,2-3,6-9,12-15H2

Properties

logBB: Blood-brain distribution

Value	Source or prediction
0.44	experimental value
1.039	Eq2: Model for drug-like chemicals, in vivo (Training set)
1.0126	Eq5: Model for all chemicals, in vivo and in vitro (Training set)

Links to External Resources

Link	Resource description
DTXSID6023446	US EPA CompTox Dashboard