10967/269 - QDB Compounds

QsarDB Repository

Akinola, L. K.; Uzairu, A.; Shallangwa, G. A.; Abechi, S. E. Development of binary classification models for grouping hydroxylated polychlorinated biphenyls into active and inactive thyroid hormone receptor agonists. SAR and QSAR in Environmental Research 2023, 34, 267–284.

Compound

ID:A16
Name:2',5'-dichlorobiphenyl-2-ol
Description:
Labels:
CAS:
InChi Code:InChI=1S/C12H8Cl2O/c13-8-5-6-11(14)10(7-8)9-3-1-2-4-12(9)15/h1-7,15H

Properties

TR_activity: Thyroid receptor agonism

ValueSource or prediction
active

experimental value

active

LDA: LDA model (Test set)

active

LR: LR model (Test set)