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: | 1542 | |
|---|---|---|
| Name: | 6-hexyl-1,2,3,4-tetrahydronaphthalene | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: 2-hexyl tetralin | |
| Labels: | ||
| CAS: | ||
| InChi Code: | InChI=1S/C16H24/c1-2-3-4-5-8-14-11-12-15-9-6-7-10-16(15)13-14/h11-13H,2-10H2,1H3 |
Properties
M5.logHLn: Biotransformation half-lives in fish
| Value | Source or prediction |
|---|---|
| 0.630825461 |
experimental value |
| 1.0564 |
Tab2.Model_5: Metab. biotransf. fish (Training set) |