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: | 336 | |
|---|---|---|
| Name: | 4-(benzyloxy)phenol | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: 4-(Benzyloxyl)phenol | |
| Labels: | ||
| CAS: | 103-16-2 | |
| InChi Code: | InChI=1S/C13H12O2/c14-12-6-8-13(9-7-12)15-10-11-4-2-1-3-5-11/h1-9,14H,10H2 |
Properties
M4.logRBA: Estrogen receptor relative binding affinity as log(RBA)
| Value | Source or prediction |
|---|---|
| -3.44 |
experimental value |
| -2.5243 |
Tab2.Model_4: EDC estrogen receptor binding (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID2020717 | US EPA CompTox Dashboard |