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: | 2217-44-9 | |
|---|---|---|
| Name: | Iodophthalein sodium | |
| Description: | ||
| Labels: | eval | |
| CAS: | 2217-44-9 | |
| InChi Code: | InChI=1S/C20H10I4O4/c21-13-5-9(6-14(22)18(13)25)17(10-7-15(23)19(26)16(24)8-10)11-3-1-2-4-12(11)20(27)28/h1-8,25H,(H,27,28) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.291568152 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |