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: | 3758-34-7 | |
|---|---|---|
| Name: | beta-Estradiol 17-propionate | |
| Description: | ||
| Labels: | eval | |
| CAS: | 3758-34-7 | |
| InChi Code: | InChI=1S/C21H28O3/c1-3-20(23)24-19-9-8-18-17-6-4-13-12-14(22)5-7-15(13)16(17)10-11-21(18,19)2/h5,7,12,16-19,22H,3-4,6,8-11H2,1-2H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 1 |
experimental value |
| 0.713628773 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |