Aruoja, V.; Moosus, M.; Kahru, A.; Sihtmäe, M.; Maran, U. Measurement of baseline toxicity and QSAR analysis of 50 non-polar and 58 polar narcotic chemicals for the alga Pseudokirchneriella subcapitata. Chemosphere 2014, 96, 23-32
Compound
| ID: | 98 | |
|---|---|---|
| Name: | 3,4-dichlorotoluene | |
| Description: | ||
| Labels: | Validation, Benzenes, Nonpolar_narcotics | |
| CAS: | 95-75-0 | |
| InChi Code: | InChI=1S/C7H6Cl2/c1-5-2-3-6(8)7(9)4-5/h2-4H,1H3 |
Properties
pEC50: 72-h Algal toxicity as log(1/EC50) [log(L/mmol)]
| Value | Source or prediction |
|---|---|
| 1.8 |
experimental value |
| 1.663 |
Tab4a: Baseline model (Training) |
| 1.903 |
Tab4b: Main model (Validation) |
| 1.93 |
Tab4c: Response surface model (Validation) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID2021814 | US EPA CompTox Dashboard |