10967/259 - QDB Compounds

QsarDB Repository

Piir, G.; Sild, S.; Maran, U. Interpretable machine learning for the identification of estrogen receptor agonists, antagonists, and binders. Chemosphere 2023.

Compound

ID:e1475
Name:Epichlorohydrin
Description:
Labels:
CAS:106-89-8
InChi Code:InChI=1S/C3H5ClO/c4-1-3-2-5-3/h3H,1-2H2

Properties

er_ant: Activity in ER antagonist pathway

ValueSource or prediction
inactive

experimental value

inactive

Tab3.antagonists: Model for ER activity on antagonists pathway (Evaluation set)