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: | 54350-48-0 | |
|---|---|---|
| Name: | Etretinate | |
| Description: | ||
| Labels: | eval | |
| CAS: | 54350-48-0 | |
| InChi Code: | InChI=1S/C23H30O3/c1-8-26-23(24)14-17(3)11-9-10-16(2)12-13-21-18(4)15-22(25-7)20(6)19(21)5/h9-15H,8H2,1-7H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 1 |
experimental value |
| 0.071597506 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |