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: | 101-77-9 | |
|---|---|---|
| Name: | 4,4'-Methylenedianiline | |
| Description: | ||
| Labels: | training | |
| CAS: | 101-77-9 | |
| InChi Code: | InChI=1S/C13H14N2/c14-12-5-1-10(2-6-12)9-11-3-7-13(15)8-4-11/h1-8H,9,14-15H2 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.021350363 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |