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:e1474
Name:1,2-Epoxybutane
Description:
Labels:
CAS:106-88-7
InChi Code:InChI=1S/C4H8O/c1-2-4-3-5-4/h4H,2-3H2,1H3

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)