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: | 25122-46-7 | |
|---|---|---|
| Name: | Clobetasol propionate | |
| Description: | ||
| Labels: | eval | |
| CAS: | 25122-46-7 | |
| InChi Code: | InChI=1S/C25H32ClFO5/c1-5-21(31)32-25(20(30)13-26)14(2)10-18-17-7-6-15-11-16(28)8-9-22(15,3)24(17,27)19(29)12-23(18,25)4/h8-9,11,14,17-19,29H,5-7,10,12-13H2,1-4H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 1 |
experimental value |
| 0.133261656 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |