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:490
Name:Terbufos sulfoxide
Description:
Labels:training, Organic_phosphides
CAS:10548-10-4
InChi Code:InChI=1S/C9H21O3PS3/c1-6-11-13(14,12-7-2)15-8-16(10)9(3,4)5/h6-8H2,1-5H3

Properties

logKoc: Logarithm of soil sorption coefficient i

ValueSource or prediction
2.18

experimental value

2.35

Eq1: Linear correlation with logP (Training set)

2.27

Eq2: Non-linear regression model (Training set)

2.27

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

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