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: | 6373-74-6 | |
|---|---|---|
| Name: | C.I. Acid Orange 3 | |
| Description: | ||
| Labels: | eval | |
| CAS: | 6373-74-6 | |
| InChi Code: | InChI=1S/C18H14N4O7S/c23-21(24)14-7-9-15(17(11-14)22(25)26)20-13-6-8-16(18(10-13)30(27,28)29)19-12-4-2-1-3-5-12/h1-11,19-20H,(H,27,28,29) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.16402234 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |