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: | 4800-94-6 | |
|---|---|---|
| Name: | Carbenicillin disodium | |
| Description: | ||
| Labels: | eval | |
| CAS: | 4800-94-6 | |
| InChi Code: | InChI=1S/C17H18N2O6S/c1-17(2)11(16(24)25)19-13(21)10(14(19)26-17)18-12(20)9(15(22)23)8-6-4-3-5-7-8/h3-7,9-11,14H,1-2H3,(H,18,20)(H,22,23)(H,24,25) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.1153065 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |