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: | 53179-07-0 | |
|---|---|---|
| Name: | Nisoxetine | |
| Description: | ||
| Labels: | eval | |
| CAS: | 53179-07-0 | |
| InChi Code: | InChI=1S/C17H21NO2/c1-18-13-12-15(14-8-4-3-5-9-14)20-17-11-7-6-10-16(17)19-2/h3-11,15,18H,12-13H2,1-2H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.034659768 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |