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: | 25 | |
|---|---|---|
| Name: | 3,5,7-trihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one | |
| Description: | ||
| Labels: | ||
| CAS: | 520-18-3 | |
| InChi Code: | InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H |
Properties
logER-RBA: Estrogen receptor binding in rat uterine cytosol [%]
| Value | Source or prediction |
|---|---|
| -1.61 |
experimental value |
| -1.7 |
QSAR: Model for estrogen receptor relative binding affinity (Training set) |