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:5766-67-6
Name:(Ethylenedinitrilo)tetraacetonitrile
Description:
Labels:eval
CAS:5766-67-6
InChi Code:InChI=1S/C10H12N6/c11-1-5-15(6-2-12)9-10-16(7-3-13)8-4-14/h5-10H2

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.00301062

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