Gramatica, P.; Chirico, N.; Papa, E.; Cassani, S.; Kovarich, S. QSARINS: A new software for the development, analysis, and validation of QSAR MLR models. Journal of Computational Chemistry 2013, 34, 2121–2132.
Compound
| ID: | 118 | |
|---|---|---|
| Name: | propoxur | |
| Description: | ||
| Labels: | Training | |
| CAS: | 114-26-1 | |
| InChi Code: | InChI=1S/C11H15NO3/c1-8(2)14-9-6-4-5-7-10(9)15-11(13)12-3/h4-8H,1-3H3,(H,12,13) |
Properties
PBT_Index: PBT Index i
| Value | Source or prediction |
|---|---|
| 0.04 |
experimental value |
| -0.552 |
Eq1: Full model (Training set) |
| -0.653 |
Eq2: Split model (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID7021948 | US EPA CompTox Dashboard |