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: | 1234 | |
|---|---|---|
| Name: | 1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: Naphthalene. decahydro- (trans) | |
| Labels: | ||
| CAS: | 493-02-7 | |
| InChi Code: | InChI=1/C10H18/c1-2-6-10-8-4-3-7-9(10)5-1/h9-10H,1-8H2/t9-,10- |
Properties
M5.logHLn: Biotransformation half-lives in fish
| Value | Source or prediction |
|---|---|
| 1.500825461 |
experimental value |
| 0.4304 |
Tab2.Model_5: Metab. biotransf. fish (Training set) |