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:505
Name:Fenthion
Description:
Labels:training, Organic_phosphides
CAS:55-38-9
InChi Code:InChI=1S/C10H15O3PS2/c1-8-7-9(5-6-10(8)16-4)13-14(15,11-2)12-3/h5-7H,1-4H3

Properties

logKoc: Logarithm of soil sorption coefficient i

ValueSource or prediction
3.18

experimental value

3.26

Eq1: Linear correlation with logP (Training set)

3.16

Eq2: Non-linear regression model (Training set)

3.16

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

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