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: | 120958-90-9 | |
|---|---|---|
| Name: | Dalcotidine | |
| Description: | ||
| Labels: | eval | |
| CAS: | 120958-90-9 | |
| InChi Code: | InChI=1S/C18H29N3O2/c1-2-19-18(22)20-10-7-13-23-17-9-6-8-16(14-17)15-21-11-4-3-5-12-21/h6,8-9,14H,2-5,7,10-13,15H2,1H3,(H2,19,20,22) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.049387607 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |