Gramatica, P.; Cassani, S.; Chirico, N. QSARINS-chem: Insubria datasets and new QSAR/QSPR models for environmental pollutants in QSARINS. J. Comput. Chem. 2014, 35, 1036–1044.
Compound
| ID: | 668 | |
|---|---|---|
| Name: | benzo[f]quinoline | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: Benzo[f]quinoline | |
| Labels: | ||
| CAS: | 85-02-9 | |
| InChi Code: | InChI=1S/C13H9N/c1-2-5-11-10(4-1)7-8-13-12(11)6-3-9-14-13/h1-9H |
Properties
M2.logKoc: Soil sorption coefficient as log(Koc) i
| Value | Source or prediction |
|---|---|
| 4.81 |
experimental value |
| 3.585 |
Tab2.Model_2: logKoc (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID2024585 | US EPA CompTox Dashboard |