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: | 114-80-7 | |
|---|---|---|
| Name: | Neostigmine bromide | |
| Description: | ||
| Labels: | eval | |
| CAS: | 114-80-7 | |
| InChi Code: | InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1 |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.068064698 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |