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: | 210826-40-7 | |
|---|---|---|
| Name: | CP-456773 | |
| Description: | ||
| Labels: | training | |
| CAS: | 210826-40-7 | |
| InChi Code: | InChI=1S/C20H24N2O5S/c1-20(2,24)14-10-17(27-11-14)28(25,26)22-19(23)21-18-15-7-3-5-12(15)9-13-6-4-8-16(13)18/h9-11,24H,3-8H2,1-2H3,(H2,21,22,23) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.168619013 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |