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: | 54504-70-0 | |
|---|---|---|
| Name: | Etofylline clofibrate | |
| Description: | ||
| Labels: | eval | |
| CAS: | 54504-70-0 | |
| InChi Code: | InChI=1S/C19H21ClN4O5/c1-19(2,29-13-7-5-12(20)6-8-13)17(26)28-10-9-24-11-21-15-14(24)16(25)23(4)18(27)22(15)3/h5-8,11H,9-10H2,1-4H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 1 |
experimental value |
| 0.325427819 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |