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: | 21850-44-2 | |
|---|---|---|
| Name: | Tetrabromobisphenol A-bis(2,3-dibromopropyl ether) | |
| Description: | ||
| Labels: | eval | |
| CAS: | 21850-44-2 | |
| InChi Code: | InChI=1S/C21H20Br8O2/c1-21(2,11-3-15(26)19(16(27)4-11)30-9-13(24)7-22)12-5-17(28)20(18(29)6-12)31-10-14(25)8-23/h3-6,13-14H,7-10H2,1-2H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.124563989 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |