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: | 14233-37-5 | |
|---|---|---|
| Name: | 1,4-Bis(N-isopropylamino)anthraquinone | |
| Description: | ||
| Labels: | training | |
| CAS: | 14233-37-5 | |
| InChi Code: | InChI=1S/C20H22N2O2/c1-11(2)21-15-9-10-16(22-12(3)4)18-17(15)19(23)13-7-5-6-8-14(13)20(18)24/h5-12,21-22H,1-4H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.090532196 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |