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: | 126-27-2 | |
|---|---|---|
| Name: | Oxethazaine | |
| Description: | ||
| Labels: | eval | |
| CAS: | 126-27-2 | |
| InChi Code: | InChI=1S/C28H41N3O3/c1-27(2,19-23-13-9-7-10-14-23)29(5)25(33)21-31(17-18-32)22-26(34)30(6)28(3,4)20-24-15-11-8-12-16-24/h7-16,32H,17-22H2,1-6H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.155886587 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |