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:1137
Name:2-phenyl-1,1'-biphenyl
Description:IUPAC names and InChI codes were generated with InstantJChem Original name was: o-Terphenyl
Labels:
CAS:84-15-1
InChi Code:InChI=1S/C18H14/c1-3-9-15(10-4-1)17-13-7-8-14-18(17)16-11-5-2-6-12-16/h1-14H

Properties

M5.logHLn: Biotransformation half-lives in fish

ValueSource or prediction
0.860825461

experimental value

1.2804

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