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:493
Name:Disulfoton
Description:
Labels:training, Organic_phosphides
CAS:298-04-4
InChi Code:InChI=1S/C8H19O2PS3/c1-4-9-11(12,10-5-2)14-8-7-13-6-3/h4-8H2,1-3H3

Properties

logKoc: Logarithm of soil sorption coefficient i

ValueSource or prediction
3.22

experimental value

3.18

Eq1: Linear correlation with logP (Training set)

3.08

Eq2: Non-linear regression model (Training set)

3.08

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

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