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: | 220860-50-4 | |
|---|---|---|
| Name: | CP-457920 | |
| Description: | ||
| Labels: | training | |
| CAS: | 220860-50-4 | |
| InChi Code: | InChI=1S/C18H17N3O3/c1-2-24-15-9-8-14-16(21-15)17(22)13(11-19-14)18(23)20-10-12-6-4-3-5-7-12/h3-9,11H,2,10H2,1H3,(H,19,22)(H,20,23) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.072286496 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |