10967/159 - QDB Compounds

QsarDB Repository

Wen, Y.; Su, L. M.; Qin, W. C.; Fu, L.; He, J.; Zhao, Y. H. Linear and non-linear relationships between soil sorption and hydrophobicity: Model, validation and influencing factors. Chemosphere 2012, 86, 634–640.

Compound

ID:408
Name:3,5,6-Trichloro-2-pyridinol
Description:
Labels:training, Aromatic_Heterocycles
CAS:6515-38-4
InChi Code:InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)

Properties

logKoc: Logarithm of soil sorption coefficient i

ValueSource or prediction
2.1

experimental value

2.43

Eq1: Linear correlation with logP (Training set)

2.35

Eq2: Non-linear regression model (Training set)

2.35

Eq3: Non-linear regression model with correction factors (Training set)

Links to External Resources