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: | 107-45-9 | |
|---|---|---|
| Name: | 2,4,4-Trimethyl-2-pentanamine | |
| Description: | ||
| Labels: | eval | |
| CAS: | 107-45-9 | |
| InChi Code: | InChI=1S/C8H19N/c1-7(2,3)6-8(4,5)9/h6,9H2,1-5H3 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.003106506 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |