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:19438-61-0
Name:4-Methylphthalic anhydride
Description:
Labels:eval
CAS:19438-61-0
InChi Code:InChI=1S/C9H6O3/c1-5-2-3-6-7(4-5)9(11)12-8(6)10/h2-4H,1H3

Properties

bindingClass: Androgen Receptor Binding Class

ValueSource or prediction
0

experimental value

0.045277634

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