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: | 122-62-3 | |
|---|---|---|
| Name: | Bis(2-ethylhexyl) decanedioate | |
| Description: | ||
| Labels: | training | |
| CAS: | 122-62-3 | |
| InChi Code: | InChI=1S/C26H50O4/c1-5-9-17-23(7-3)21-29-25(27)19-15-13-11-12-14-16-20-26(28)30-22-24(8-4)18-10-6-2/h23-24H,5-22H2,1-4H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.005032685 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |