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: | 18 | |
|---|---|---|
| Name: | 2-hydroxybenzoic acid | |
| Description: | ||
| Labels: | Training | |
| CAS: | 69-72-7 | |
| InChi Code: | InChI=1S/C7H6O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H,(H,9,10) |
Properties
PBT_Index: PBT Index i
| Value | Source or prediction |
|---|---|
| -0.6 |
experimental value |
| -0.896 |
Eq1: Full model (Training set) |
| -0.994 |
Eq2: Split model (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID7026368 | US EPA CompTox Dashboard |