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: | 21245-02-3 | |
|---|---|---|
| Name: | 2-Ethylhexyl 4-(dimethylamino)benzoate | |
| Description: | ||
| Labels: | training | |
| CAS: | 21245-02-3 | |
| InChi Code: | InChI=1S/C17H27NO2/c1-5-7-8-14(6-2)13-20-17(19)15-9-11-16(12-10-15)18(3)4/h9-12,14H,5-8,13H2,1-4H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.048897972 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |