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: | 179465-71-5 | |
|---|---|---|
| Name: | CJ-013790 | |
| Description: | ||
| Labels: | training | |
| CAS: | 179465-71-5 | |
| InChi Code: | InChI=1S/C18H17FN2O4/c19-12-4-7-14(8-5-12)24-15-2-1-3-16(11-15)25-17-9-6-13(10-17)21(23)18(20)22/h1-9,11,13,17,23H,10H2,(H2,20,22)/t13-,17+/m1/s1 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.149178719 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |