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: | 55406-53-6 | |
|---|---|---|
| Name: | 3-Iodo-2-propynyl-N-butylcarbamate | |
| Description: | ||
| Labels: | training | |
| CAS: | 55406-53-6 | |
| InChi Code: | InChI=1S/C8H12INO2/c1-2-3-6-10-8(11)12-7-4-5-9/h2-3,6-7H2,1H3,(H,10,11) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 1 |
experimental value |
| 0.003505372 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |