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: | 113617-63-3 | |
|---|---|---|
| Name: | Orbifloxacin | |
| Description: | ||
| Labels: | eval | |
| CAS: | 113617-63-3 | |
| InChi Code: | InChI=1S/C19H20F3N3O3/c1-8-5-24(6-9(2)23-8)17-14(21)13(20)12-16(15(17)22)25(10-3-4-10)7-11(18(12)26)19(27)28/h7-10,23H,3-6H2,1-2H3,(H,27,28) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 1 |
experimental value |
| 0.017513519 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |