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: | 51-24-1 | |
|---|---|---|
| Name: | Tiratricol | |
| Description: | ||
| Labels: | training | |
| CAS: | 51-24-1 | |
| InChi Code: | InChI=1S/C14H9I3O4/c15-9-6-8(1-2-12(9)18)21-14-10(16)3-7(4-11(14)17)5-13(19)20/h1-4,6,18H,5H2,(H,19,20) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.280801683 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |