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:1828
Name:N,N-dimethylpyridin-2-amine
Description:IUPAC names and InChI codes were generated with InstantJChem Original name was: 2-Dimethylaminopyridine
Labels:
CAS:5683-33-0
InChi Code:InChI=1S/C7H10N2/c1-9(2)7-5-3-4-6-8-7/h3-6H,1-2H3

Properties

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

ValueSource or prediction
2.98

experimental value

2.5932

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

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