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: | 2740-04-7 | |
|---|---|---|
| Name: | Dimefline hydrochloride | |
| Description: | ||
| Labels: | eval | |
| CAS: | 2740-04-7 | |
| InChi Code: | InChI=1S/C20H21NO3/c1-13-18(22)15-10-11-17(23-4)16(12-21(2)3)20(15)24-19(13)14-8-6-5-7-9-14/h5-11H,12H2,1-4H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.055908843 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |