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: | 18559-59-6 | |
|---|---|---|
| Name: | Trimethoquinol | |
| Description: | ||
| Labels: | eval | |
| CAS: | 18559-59-6 | |
| InChi Code: | InChI=1S/C19H23NO5/c1-23-17-7-11(8-18(24-2)19(17)25-3)6-14-13-10-16(22)15(21)9-12(13)4-5-20-14/h7-10,14,20-22H,4-6H2,1-3H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.124992585 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |