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: | 83966-24-9 | |
|---|---|---|
| Name: | 1,2,3-Propanetricarboxylic acid,2-hydroxy-,2-(1-methylethyl)ester | |
| Description: | ||
| Labels: | eval | |
| CAS: | 83966-24-9 | |
| InChi Code: | InChI=1S/C9H14O7/c1-5(2)16-8(14)9(15,3-6(10)11)4-7(12)13/h5,15H,3-4H2,1-2H3,(H,10,11)(H,12,13) |
Properties
bindingClass: Androgen Receptor Binding Class
| Value | Source or prediction |
|---|---|
| 0 |
experimental value |
| 0.003145498 |
Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class) |