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:1475
Name:3,3',4,4',5-pentachloro-1,1'-biphenyl
Description:IUPAC names and InChI codes were generated with InstantJChem Original name was: 3.3'.4.4'.5-Pentachloro-1.1'-biphenyl
Labels:
CAS:57465-28-8
InChi Code:InChI=1S/C12H5Cl5/c13-8-2-1-6(3-9(8)14)7-4-10(15)12(17)11(16)5-7/h1-5H

Properties

M5.logHLn: Biotransformation half-lives in fish

ValueSource or prediction
2.400825461

experimental value

2.1063

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

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