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: | 58-94-6 | |
|---|---|---|
| Name: | Chlorothiazide | |
| Description: | ||
| Labels: | eval | |
| CAS: | 58-94-6 | |
| InChi Code: | InChI=1S/C7H6ClN3O4S2/c8-4-1-5-7(2-6(4)16(9,12)13)17(14,15)11-3-10-5/h1-3H,(H,10,11)(H2,9,12,13) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.090632694 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |