10967/234 - QDB Compounds

QsarDB Repository

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:3855-32-1
Name:2,6,10-Trimethyl-2,6,10-triazaundecane
Description:
Labels:training
CAS:3855-32-1
InChi Code:InChI=1S/C11H27N3/c1-12(2)8-6-10-14(5)11-7-9-13(3)4/h6-11H2,1-5H3
Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value
0.006141864

Proc.13: Procedure 13, Multivariate Logistic Regression (predicted Binding Class)