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: | 120066-54-8 | |
|---|---|---|
| Name: | Gadoteridol | |
| Description: | ||
| Labels: | eval | |
| CAS: | 120066-54-8 | |
| InChi Code: | InChI=1S/C17H32N4O7/c1-14(22)10-18-2-4-19(11-15(23)24)6-8-21(13-17(27)28)9-7-20(5-3-18)12-16(25)26/h14,22H,2-13H2,1H3,(H,23,24)(H,25,26)(H,27,28) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.005841017 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |