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: | np124 | |
|---|---|---|
| Name: | pyrene | |
| Description: | ||
| Labels: | ||
| CAS: | 129-00-0 | |
| InChi Code: | InChI=1S/C16H10/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14/h1-10H |
Properties
NOEC: Chronic fish toxicity as logNOEC [log(mmol/L)]
| Value | Source or prediction |
|---|---|
| -4.61 |
experimental value |
| -3.697 |
Tab3.Eq1: Nonpolar narcosis (Test set) |
| -3.694 |
QMRF1: Nonpolar narcosis (Test set) |