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: | 1449 | |
|---|---|---|
| Name: | 2,2',3,6'-tetrachloro-1,1'-biphenyl | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: 2.2'.3.6'-tetrachlorobiphenyl | |
| Labels: | ||
| CAS: | 41464-47-5 | |
| InChi Code: | InChI=1S/C12H6Cl4/c13-8-4-2-5-9(14)11(8)7-3-1-6-10(15)12(7)16/h1-6H |
Properties
M5.logHLn: Biotransformation half-lives in fish
| Value | Source or prediction |
|---|---|
| 2.180825461 |
experimental value |
| 1.9137 |
Tab2.Model_5: Metab. biotransf. fish (Training set) |