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: | 21216-78-4 | |
|---|---|---|
| Name: | Anacolin | |
| Description: | ||
| Labels: | eval | |
| CAS: | 21216-78-4 | |
| InChi Code: | InChI=1S/C22H28NO2/c1-23(15-9-4-10-16-23)17-21-18-24-22(25-21,19-11-5-2-6-12-19)20-13-7-3-8-14-20/h2-3,5-8,11-14,21H,4,9-10,15-18H2,1H3/q+1 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.068116168 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |