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: | 1843-05-6 | |
|---|---|---|
| Name: | Octabenzone | |
| Description: | ||
| Labels: | training | |
| CAS: | 1843-05-6 | |
| InChi Code: | InChI=1S/C21H26O3/c1-2-3-4-5-6-10-15-24-18-13-14-19(20(22)16-18)21(23)17-11-8-7-9-12-17/h7-9,11-14,16,22H,2-6,10,15H2,1H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.27354439 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |