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: | 156 | |
|---|---|---|
| Name: | Didesipramine | |
| Description: | Alternative names from original table: (Desmethyldesipramine or Desdimethylimipramine) | |
| Labels: | Blood, in_vivo | |
| CAS: | ||
| InChi Code: | InChI=1S/C17H20N2/c18-12-5-13-19-16-8-3-1-6-14(16)10-11-15-7-2-4-9-17(15)19/h1-4,6-9H,5,10-13,18H2 |
Properties
logBB: Blood-brain distribution
| Value | Source or prediction |
|---|---|
| 1.06 |
experimental value |
| 0.516 |
Eq2: Model for drug-like chemicals, in vivo (Training set) |
| 0.4825 |
Eq5: Model for all chemicals, in vivo and in vitro (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID50175131 | US EPA CompTox Dashboard |