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: | 692 | |
|---|---|---|
| Name: | Warfarin | |
| Description: | ||
| Labels: | validation, Other_compounds | |
| CAS: | 81-81-2 | |
| InChi Code: | InChI=1S/C19H16O4/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22/h2-10,15,21H,11H2,1H3 |
Properties
logKoc: Logarithm of soil sorption coefficient i
| Value | Source or prediction |
|---|---|
| 2.96 |
experimental value |
| 2.23 |
Eq1: Linear correlation with logP (Validation set) |
| 2.17 |
Eq2: Non-linear regression model (Validation set) |
| 2.17 |
Eq3: Non-linear regression model with correction factors (Validation set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID5023742 | US EPA CompTox Dashboard |