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: | 204519-65-3 | |
|---|---|---|
| Name: | Gemifloxacin mesylate | |
| Description: | ||
| Labels: | eval | |
| CAS: | 204519-65-3 | |
| InChi Code: | InChI=1S/C18H20FN5O4/c1-28-22-14-8-23(6-9(14)5-20)17-13(19)4-11-15(25)12(18(26)27)7-24(10-2-3-10)16(11)21-17/h4,7,9-10H,2-3,5-6,8,20H2,1H3,(H,26,27) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.108181866 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |