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: | 2043-57-4 | |
|---|---|---|
| Name: | 1H,1H,2H,2H-Perfluorooctyl iodide | |
| Description: | ||
| Labels: | training | |
| CAS: | 2043-57-4 | |
| InChi Code: | InChI=1S/C8H4F13I/c9-3(10,1-2-22)4(11,12)5(13,14)6(15,16)7(17,18)8(19,20)21/h1-2H2 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.008006449 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |