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: | 152946-68-4 | |
|---|---|---|
| Name: | Nolatrexed dihydrochloride | |
| Description: | ||
| Labels: | eval | |
| CAS: | 152946-68-4 | |
| InChi Code: | InChI=1S/C14H12N4OS/c1-8-2-3-10-11(13(19)18-14(15)17-10)12(8)20-9-4-6-16-7-5-9/h2-7H,1H3,(H3,15,17,18,19) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.157490049 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |