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: | 1050-79-9 | |
|---|---|---|
| Name: | Moperone | |
| Description: | ||
| Labels: | eval | |
| CAS: | 1050-79-9 | |
| InChi Code: | InChI=1S/C22H26FNO2/c1-17-4-8-19(9-5-17)22(26)12-15-24(16-13-22)14-2-3-21(25)18-6-10-20(23)11-7-18/h4-11,26H,2-3,12-16H2,1H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.238325736 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |