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: | 25803-14-9 | |
|---|---|---|
| Name: | Clometacine | |
| Description: | ||
| Labels: | eval | |
| CAS: | 25803-14-9 | |
| InChi Code: | InChI=1S/C19H16ClNO4/c1-11-18(19(24)12-3-5-13(20)6-4-12)15-8-7-14(25-2)9-16(15)21(11)10-17(22)23/h3-9H,10H2,1-2H3,(H,22,23) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.500185397 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |