10967/177 - QDB Compounds

QsarDB Repository

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:1408
Name:2,3-dichlorooxanthrene
Description:IUPAC names and InChI codes were generated with InstantJChem Original name was: 2.3-Dichlorodibenzo-p-dioxin
Labels:
CAS:29446-15-9
InChi Code:InChI=1S/C12H6Cl2O2/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H

Properties

M5.logHLn: Biotransformation half-lives in fish

ValueSource or prediction
0.330825461

experimental value

1.242

Tab2.Model_5: Metab. biotransf. fish (Training set)

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