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: | 2259-96-3 | |
|---|---|---|
| Name: | Cyclothiazide | |
| Description: | ||
| Labels: | eval | |
| CAS: | 2259-96-3 | |
| InChi Code: | InChI=1S/C14H16ClN3O4S2/c15-10-5-11-13(6-12(10)23(16,19)20)24(21,22)18-14(17-11)9-4-7-1-2-8(9)3-7/h1-2,5-9,14,17-18H,3-4H2,(H2,16,19,20) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.111155933 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |