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: | 15619-48-4 | |
|---|---|---|
| Name: | 1-Benzylquinolinium chloride | |
| Description: | ||
| Labels: | training | |
| CAS: | 15619-48-4 | |
| InChi Code: | InChI=1S/C16H14N/c1-2-7-14(8-3-1)13-17-12-6-10-15-9-4-5-11-16(15)17/h1-12H,13H2/q+1 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.015687371 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |