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: | p45 | |
|---|---|---|
| Name: | 2,2-bis(4-hydroxyphenyl)propane | |
| Description: | ||
| Labels: | ||
| CAS: | 80-05-7 | |
| InChi Code: | InChI=1S/C15H16O2/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12/h3-10,16-17H,1-2H3 |
Properties
NOEC: Chronic fish toxicity as logNOEC [log(mmol/L)]
| Value | Source or prediction |
|---|---|
| -4.15 |
experimental value |
| -2.682 |
Tab3.Eq2: Polar narcosis (Training set) |
| -2.613 |
QMRF2: Polar narcosis (Training set) |