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:	248
	Name:	Rolipram
	Description:
	Labels:	Blood, in_vivo
	CAS:
	InChi Code:	InChI=1S/C16H21NO3/c1-19-14-7-6-11(12-9-16(18)17-10-12)8-15(14)20-13-4-2-3-5-13/h6-8,12-13H,2-5,9-10H2,1H3,(H,17,18)

Properties

logBB: Blood-brain distribution

Value	Source or prediction
0.61	experimental value
0.325	Eq2: Model for drug-like chemicals, in vivo (Training set)
0.3128	Eq5: Model for all chemicals, in vivo and in vitro (Training set)

Links to External Resources

Link	Resource description
DTXSID3044124	US EPA CompTox Dashboard