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: | 53016-31-2 | |
|---|---|---|
| Name: | Norelgestromin | |
| Description: | ||
| Labels: | eval | |
| CAS: | 53016-31-2 | |
| InChi Code: | InChI=1S/C21H29NO2/c1-3-20-11-9-17-16-8-6-15(22-24)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h2,13,15-19,23H,3,5-12H2,1H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 1 |
experimental value |
| 0.247632034 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |