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:581
Name:Dimethipin
Description:
Labels:training, Sulfone_derivatives
CAS:55290-64-7
InChi Code:InChI=1S/C6H10O4S2/c1-5-6(2)12(9,10)4-3-11(5,7)8/h3-4H2,1-2H3

Properties

logKoc: Logarithm of soil sorption coefficient i

ValueSource or prediction
0.48

experimental value

-1.72

Eq1: Linear correlation with logP (Training set)

0.33

Eq2: Non-linear regression model (Training set)

0.33

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

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