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: | 126-00-1 | |
|---|---|---|
| Name: | Diphenolic acid | |
| Description: | ||
| Labels: | training | |
| CAS: | 126-00-1 | |
| InChi Code: | InChI=1S/C17H18O4/c1-17(11-10-16(20)21,12-2-6-14(18)7-3-12)13-4-8-15(19)9-5-13/h2-9,18-19H,10-11H2,1H3,(H,20,21) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.388903132 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |