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: | 68 | |
|---|---|---|
| Name: | (2E)-1-(4-hydroxyphenyl)-3-phenylprop-2-en-1-one | |
| Description: | ||
| Labels: | ||
| CAS: | 2657-25-2 | |
| InChi Code: | InChI=1S/C15H12O2/c16-14-9-7-13(8-10-14)15(17)11-6-12-4-2-1-3-5-12/h1-11,16H/b11-6+ |
Properties
logER-RBA: Estrogen receptor binding in rat uterine cytosol [%]
| Value | Source or prediction |
|---|---|
| -2.43 |
experimental value |
| -2.77 |
QSAR: Model for estrogen receptor relative binding affinity (Test set) |