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:489
Name:Methidathion
Description:
Labels:training, Organic_phosphides
CAS:950-37-8
InChi Code:InChI=1S/C6H11N2O4PS3/c1-10-5-7-8(6(9)16-5)4-15-13(14,11-2)12-3/h4H2,1-3H3

Properties

logKoc: Logarithm of soil sorption coefficient i

ValueSource or prediction
1.53

experimental value

1.21

Eq1: Linear correlation with logP (Training set)

1.45

Eq2: Non-linear regression model (Training set)

1.45

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

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