10967/106 - QDB Compounds

QsarDB Repository

Aruoja, V.; Moosus, M.; Kahru, A.; Sihtmäe, M.; Maran, U. Measurement of baseline toxicity and QSAR analysis of 50 non-polar and 58 polar narcotic chemicals for the alga Pseudokirchneriella subcapitata. Chemosphere 2014, 96, 23-32

Compound

ID:102
Name:3-chlorophenol
Description:
Labels:Validation, Phenols, Polar_narcotics
CAS:108-43-0
InChi Code:InChI=1S/C6H5ClO/c7-5-2-1-3-6(8)4-5/h1-4,8H
Properties

pEC50: 72-h Algal toxicity as log(1/EC50) [log(L/mmol)]

ValueSource or prediction
1.05

experimental value
0.542

Tab4b: Main model (Validation)
0.809

Tab4c: Response surface model (Validation)

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