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:108-20-3
Name:Isopropyl ether
Description:
Labels:eval
CAS:108-20-3
InChi Code:InChI=1S/C6H14O/c1-5(2)7-6(3)4/h5-6H,1-4H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.001991357

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