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: | 82-02-0 | |
|---|---|---|
| Name: | Khellin | |
| Description: | ||
| Labels: | eval | |
| CAS: | 82-02-0 | |
| InChi Code: | InChI=1S/C14H12O5/c1-7-6-9(15)10-11(16-2)8-4-5-18-12(8)14(17-3)13(10)19-7/h4-6H,1-3H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.150276507 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |