Claeys, L.; Iaccino, F.; Janssen, C. R.; Van Sprang, P.; Verdonck, F. Development and validation of a quantitative structure-activity relationship for chronic narcosis to fish. Environ. Toxicol. Chem. 2013, 32, 2217–2225.
Compound
| ID: | np52 | |
|---|---|---|
| Name: | butanol | |
| Description: | ||
| Labels: | ||
| CAS: | 71-36-3 | |
| InChi Code: | InChI=1S/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3 |
Properties
NOEC: Chronic fish toxicity as logNOEC [log(mmol/L)]
| Value | Source or prediction |
|---|---|
| -0.207 |
experimental value |
| 0.064 |
Tab3.Eq1: Nonpolar narcosis (Training set) |
| 0.066 |
QMRF1: Nonpolar narcosis (Training set) |