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: | 139-08-2 | |
|---|---|---|
| Name: | Tetradecyldimethylbenzylammonium chloride | |
| Description: | ||
| Labels: | eval | |
| CAS: | 139-08-2 | |
| InChi Code: | InChI=1S/C23H42N/c1-4-5-6-7-8-9-10-11-12-13-14-18-21-24(2,3)22-23-19-16-15-17-20-23/h15-17,19-20H,4-14,18,21-22H2,1-3H3/q+1 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 1 |
experimental value |
| 0.141752825 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |