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:1854
Name:6-chloropyridin-2-ol
Description:IUPAC names and InChI codes were generated with InstantJChem Original name was: 6-Chloro-2-pyridinol
Labels:
CAS:16879-02-0
InChi Code:InChI=1S/C5H4ClNO/c6-4-2-1-3-5(8)7-4/h1-3H,(H,7,8)

Properties

M1.pLC50: 96-h Fathead minnow toxicity as log(1/LC50) [-log(mol/L)]

ValueSource or prediction
2.78

experimental value

3.0123

Tab2.Model_1: P. promelas LC50 (Training set)

Links to External Resources