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: | 26040-51-7 | |
|---|---|---|
| Name: | Bis(2-ethylhexyl) tetrabromophthalate | |
| Description: | ||
| Labels: | training | |
| CAS: | 26040-51-7 | |
| InChi Code: | InChI=1S/C24H34Br4O4/c1-5-9-11-15(7-3)13-31-23(29)17-18(20(26)22(28)21(27)19(17)25)24(30)32-14-16(8-4)12-10-6-2/h15-16H,5-14H2,1-4H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.014240707 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |