Garcia-Sosa, A. T.; Maran, U. Using combined docking, chemical fingerprints, and Bayesian classifiers for the androgen receptor binding activity of the CoMPARA data. Toxicological Sciences 2020.
Compound
| ID: | 4245-41-4 | |
|---|---|---|
| Name: | Estradiol acetate | |
| Description: | ||
| Labels: | eval | |
| CAS: | 4245-41-4 | |
| InChi Code: | InChI=1S/C20H26O3/c1-12(21)23-14-4-6-15-13(11-14)3-5-17-16(15)9-10-20(2)18(17)7-8-19(20)22/h4,6,11,16-19,22H,3,5,7-10H2,1-2H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 1 |
experimental value |
| 0.484408775 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |