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: | 666-99-9 | |
|---|---|---|
| Name: | Agaric acid | |
| Description: | ||
| Labels: | eval | |
| CAS: | 666-99-9 | |
| InChi Code: | InChI=1S/C22H40O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(20(25)26)22(29,21(27)28)17-19(23)24/h18,29H,2-17H2,1H3,(H,23,24)(H,25,26)(H,27,28) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.009186319 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |