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: | 58 | |
|---|---|---|
| Name: | 2-Propen-1-one, 1,3-diphenyl- | |
| Description: | ||
| Labels: | ||
| CAS: | 94-41-7 | |
| InChi Code: | InChI=1S/C15H12O/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-12H |
Properties
logER-RBA: Estrogen receptor binding in rat uterine cytosol [%]
| Value | Source or prediction |
|---|---|
| -2.82 |
experimental value |
| -3.39 |
QSAR: Model for estrogen receptor relative binding affinity (Training set) |