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: | 1076-97-7 | |
|---|---|---|
| Name: | 1,4-Cyclohexanedicarboxylic acid | |
| Description: | ||
| Labels: | training | |
| CAS: | 1076-97-7 | |
| InChi Code: | InChI=1S/C8H12O4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h5-6H,1-4H2,(H,9,10)(H,11,12) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.011628506 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |