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: | 5321-32-4 | |
|---|---|---|
| Name: | Hetacillin potassium | |
| Description: | ||
| Labels: | eval | |
| CAS: | 5321-32-4 | |
| InChi Code: | InChI=1S/C19H23N3O4S/c1-18(2)13(17(25)26)21-15(24)12(16(21)27-18)22-14(23)11(20-19(22,3)4)10-8-6-5-7-9-10/h5-9,11-13,16,20H,1-4H3,(H,25,26) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.039484305 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |