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: | 96-70-8 | |
|---|---|---|
| Name: | 2-tert-Butyl-4-ethylphenol | |
| Description: | ||
| Labels: | training | |
| CAS: | 96-70-8 | |
| InChi Code: | InChI=1S/C12H18O/c1-5-9-6-7-11(13)10(8-9)12(2,3)4/h6-8,13H,5H2,1-4H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.238265149 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |