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: | 474-40-8 | |
|---|---|---|
| Name: | Sitosterol alpha1 | |
| Description: | ||
| Labels: | eval | |
| CAS: | 474-40-8 | |
| InChi Code: | InChI=1S/C30H50O/c1-8-22(19(2)3)10-9-20(4)24-13-14-26-23-11-12-25-21(5)28(31)16-18-30(25,7)27(23)15-17-29(24,26)6/h8,11,19-21,24-28,31H,9-10,12-18H2,1-7H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.070794556 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |