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: | 35189-28-7 | |
|---|---|---|
| Name: | Norgestimate | |
| Description: | ||
| Labels: | eval | |
| CAS: | 35189-28-7 | |
| InChi Code: | InChI=1S/C23H31NO3/c1-4-22-12-10-19-18-9-7-17(24-26)14-16(18)6-8-20(19)21(22)11-13-23(22,5-2)27-15(3)25/h2,14,17-21H,4,6-13H2,1,3H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 1 |
experimental value |
| 0.17434216 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |