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: | 6489-61-8 | |
|---|---|---|
| Name: | Metampicillin sodium | |
| Description: | ||
| Labels: | eval | |
| CAS: | 6489-61-8 | |
| InChi Code: | InChI=1S/C17H19N3O4S/c1-17(2)12(16(23)24)20-14(22)11(15(20)25-17)19-13(21)10(18-3)9-7-5-4-6-8-9/h4-8,10-12,15H,3H2,1-2H3,(H,19,21)(H,23,24) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.17405661 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |