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: | 50673-97-7 | |
|---|---|---|
| Name: | Colestolone | |
| Description: | ||
| Labels: | eval | |
| CAS: | 50673-97-7 | |
| InChi Code: | InChI=1S/C27H44O2/c1-17(2)7-6-8-18(3)23-16-24(29)25-21-10-9-19-15-20(28)11-13-26(19,4)22(21)12-14-27(23,25)5/h17-20,22-23,28H,6-16H2,1-5H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.056922883 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |