Tulp, I.; Tamm, T.; Karelson, G.; Dobchev, D.; Martin, D.; Tämm, K.; Savchenko, D.; Jänes, J.; Härk, E.; Kreegipuu, A.; Karelson, M. QSAR for relative binding affinity to estrogen receptor. Q13-418a-0021. Molcode Ltd., 2009.
Compound
| ID: | 14 | |
|---|---|---|
| Name: | (2E)-3-(4-hydroxyphenyl)-1-phenylprop-2-en-1-one | |
| Description: | ||
| Labels: | ||
| CAS: | 20426-12-4 | |
| InChi Code: | InChI=1S/C15H12O2/c16-14-9-6-12(7-10-14)8-11-15(17)13-4-2-1-3-5-13/h1-11,16H/b11-8+ |
Properties
logER-RBA: Estrogen receptor binding in rat uterine cytosol [%]
| Value | Source or prediction |
|---|---|
| -2.55 |
experimental value |
| -2.53 |
QSAR: Model for estrogen receptor relative binding affinity (Training set) |