10967/144 - QDB Compounds

QsarDB Repository

Lu, G.-H.; Yuan, X.; Zhao, Y.-H. QSAR study on the toxicity of substituted benzenes to the algae (Scenedesmus obliquus). Chemosphere 2001, 44, 437–440.

Compound

ID:32
Name: 4-Aminoethylphenolate
Description:
Labels:
CAS:
InChi Code:InChI=1S/C8H11NO/c9-6-5-7-1-3-8(10)4-2-7/h1-4,10H,5-6,9H2/p-1

Properties

pEC50: 48-h Algal toxicity as log(1/EC50) [log(mol/l)]

ValueSource or prediction
3.1

experimental value

3.88

Eq1: Substituted benzenes (Training set)