10967/187 - QDB Compounds

QsarDB Repository

Li, F.; Wu, H.; Li, L.; Li, X.; Zhao, J.; Peijnenburg, W. J. G. M. Docking and QSAR study on the binding interactions between polycyclic aromatic hydrocarbons and estrogen receptor. Ecotoxicology and Environmental Safety 2012, 80, 273 - 279.

Compound

ID:2-OHFl
Name:2-hydroxyfluorene
Description:
Labels:
CAS:
InChi Code:InChI=1S/C13H10O/c14-11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)13/h1-6,8,14H,7H2

Properties

logRBA: Relative binding affinity to hERa i

ValueSource or prediction
-0.893

experimental value

-0.766

PLS: Model for polycyclic aromatic hydrocarbons (Training set)

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