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: | 91-44-1 | |
|---|---|---|
| Name: | 7-Diethylamino-4-methylcoumarin | |
| Description: | ||
| Labels: | eval | |
| CAS: | 91-44-1 | |
| InChi Code: | InChI=1S/C14H17NO2/c1-4-15(5-2)11-6-7-12-10(3)8-14(16)17-13(12)9-11/h6-9H,4-5H2,1-3H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 1 |
experimental value |
| 0.129068296 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |