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: | 122-96-3 | |
|---|---|---|
| Name: | 1,4-Piperazinediethanol | |
| Description: | ||
| Labels: | eval | |
| CAS: | 122-96-3 | |
| InChi Code: | InChI=1S/C8H18N2O2/c11-7-5-9-1-2-10(4-3-9)6-8-12/h11-12H,1-8H2 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.011874883 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |