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: | 7177-48-2 | |
|---|---|---|
| Name: | Ampicillin trihydrate | |
| Description: | ||
| Labels: | eval | |
| CAS: | 7177-48-2 | |
| InChi Code: | InChI=1S/C16H19N3O4S/c1-16(2)11(15(22)23)19-13(21)10(14(19)24-16)18-12(20)9(17)8-6-4-3-5-7-8/h3-7,9-11,14H,17H2,1-2H3,(H,18,20)(H,22,23) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.112149812 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |