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: | 171866-31-2 | |
|---|---|---|
| Name: | CP-283097 | |
| Description: | ||
| Labels: | training | |
| CAS: | 171866-31-2 | |
| InChi Code: | InChI=1S/C20H22FNO4/c21-14-3-1-13(2-4-14)20(25)7-9-22(10-8-20)17-12-26-18-11-15(23)5-6-16(18)19(17)24/h1-6,11,17,19,23-25H,7-10,12H2/t17-,19+/m1/s1 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.492287325 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |