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: | 6620-60-6 | |
|---|---|---|
| Name: | Proglumide | |
| Description: | ||
| Labels: | eval | |
| CAS: | 6620-60-6 | |
| InChi Code: | InChI=1S/C18H26N2O4/c1-3-12-20(13-4-2)18(24)15(10-11-16(21)22)19-17(23)14-8-6-5-7-9-14/h5-9,15H,3-4,10-13H2,1-2H3,(H,19,23)(H,21,22) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.023180326 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |