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: | 480-63-7 | |
|---|---|---|
| Name: | 2,4,6-Trimethylbenzoic acid | |
| Description: | ||
| Labels: | training | |
| CAS: | 480-63-7 | |
| InChi Code: | InChI=1S/C10H12O2/c1-6-4-7(2)9(10(11)12)8(3)5-6/h4-5H,1-3H3,(H,11,12) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.035236923 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |