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: | 4130-42-1 | |
|---|---|---|
| Name: | 2,6-Di-tert-butyl-4-ethylphenol | |
| Description: | ||
| Labels: | training | |
| CAS: | 4130-42-1 | |
| InChi Code: | InChI=1S/C16H26O/c1-8-11-9-12(15(2,3)4)14(17)13(10-11)16(5,6)7/h9-10,17H,8H2,1-7H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.186744006 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |