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: | 8004-92-0 | |
|---|---|---|
| Name: | C.I. Acid Yellow 3 disodium salt | |
| Description: | ||
| Labels: | training | |
| CAS: | 8004-92-0 | |
| InChi Code: | InChI=1S/C18H11NO8S2/c20-17-11-3-1-2-4-12(11)18(21)15(17)13-6-5-9-7-10(28(22,23)24)8-14(16(9)19-13)29(25,26)27/h1-8,15H,(H,22,23,24)(H,25,26,27) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.144525096 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |