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: | 96-83-3 | |
|---|---|---|
| Name: | Iopanoic acid | |
| Description: | ||
| Labels: | training | |
| CAS: | 96-83-3 | |
| InChi Code: | InChI=1S/C11H12I3NO2/c1-2-5(11(16)17)3-6-7(12)4-8(13)10(15)9(6)14/h4-5H,2-3,15H2,1H3,(H,16,17) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.144645446 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |