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: | 206 | |
|---|---|---|
| Name: | Nalidixic acid | |
| Description: | ||
| Labels: | Plasma, in_vivo | |
| CAS: | ||
| InChi Code: | InChI=1S/C12H12N2O3/c1-3-14-6-9(12(16)17)10(15)8-5-4-7(2)13-11(8)14/h4-6H,3H2,1-2H3,(H,16,17) |
Properties
logBB: Blood-brain distribution
| Value | Source or prediction |
|---|---|
| -0.66 |
experimental value |
| -1.562 |
Eq2: Model for drug-like chemicals, in vivo (Training set) |
| -1.5527 |
Eq5: Model for all chemicals, in vivo and in vitro (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID3020912 | US EPA CompTox Dashboard |