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: | 120 | |
|---|---|---|
| Name: | Alovudine | |
| Description: | ||
| Labels: | Blood, in_vivo | |
| CAS: | ||
| InChi Code: | InChI=1S/C10H13FN2O4/c1-5-3-13(10(16)12-9(5)15)8-2-6(11)7(4-14)17-8/h3,6-8,14H,2,4H2,1H3,(H,12,15,16) |
Properties
logBB: Blood-brain distribution
| Value | Source or prediction |
|---|---|
| -0.59 |
experimental value |
| -0.727 |
Eq2: Model for drug-like chemicals, in vivo (Training set) |
| -0.7039 |
Eq5: Model for all chemicals, in vivo and in vitro (Training set) |