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: | 119 | |
|---|---|---|
| Name: | aldicarb | |
| Description: | ||
| Labels: | Training | |
| CAS: | 116-06-3 | |
| InChi Code: | InChI=1S/C7H14N2O2S/c1-7(2,12-4)5-9-11-6(10)8-3/h5H,1-4H3,(H,8,10) |
Properties
PBT_Index: PBT Index i
| Value | Source or prediction |
|---|---|
| -0.86 |
experimental value |
| -1.622 |
Eq1: Full model (Training set) |
| -1.708 |
Eq2: Split model (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID0039223 | US EPA CompTox Dashboard |