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: | 23597-82-2 | |
|---|---|---|
| Name: | Hexyl nicotinate | |
| Description: | ||
| Labels: | eval | |
| CAS: | 23597-82-2 | |
| InChi Code: | InChI=1S/C12H17NO2/c1-2-3-4-5-9-15-12(14)11-7-6-8-13-10-11/h6-8,10H,2-5,9H2,1H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.022306895 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |