Gramatica, P.; Cassani, S.; Chirico, N. QSARINS-chem: Insubria datasets and new QSAR/QSPR models for environmental pollutants in QSARINS. J. Comput. Chem. 2014, 35, 1036–1044.
Compound
| ID: | 1784 | |
|---|---|---|
| Name: | 4-[(E)-2-phenyldiazen-1-yl]phenol | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: p-Phenylazophenol | |
| Labels: | ||
| CAS: | 1689-82-3 | |
| InChi Code: | InChI=1S/C12H10N2O/c15-12-8-6-11(7-9-12)14-13-10-4-2-1-3-5-10/h1-9,15H/b14-13+ |
Properties
M1.pLC50: 96-h Fathead minnow toxicity as log(1/LC50) [-log(mol/L)]
| Value | Source or prediction |
|---|---|
| 5.23 |
experimental value |
| 4.2523 |
Tab2.Model_1: P. promelas LC50 (Training set) |