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: | 56-53-1 | |
|---|---|---|
| Name: | Diethylstilbestrol | |
| Description: | ||
| Labels: | training | |
| CAS: | 56-53-1 | |
| InChi Code: | InChI=1S/C18H20O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h5-12,19-20H,3-4H2,1-2H3/b18-17+ |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 1 |
experimental value |
| 0.565346746 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |