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:544-16-1
Name:N-Butylnitrite
Description:
Labels:eval
CAS:544-16-1
InChi Code:InChI=1S/C4H9NO2/c1-2-3-4-7-5-6/h2-4H2,1H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.007953234

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