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: | 2416-94-6 | |
|---|---|---|
| Name: | 2,3,6-Trimethylphenol | |
| Description: | ||
| Labels: | training | |
| CAS: | 2416-94-6 | |
| InChi Code: | InChI=1S/C9H12O/c1-6-4-5-7(2)9(10)8(6)3/h4-5,10H,1-3H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.029179207 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |