LUF6200

Ligand id: 7847

Name: LUF6200

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 0
Rotatable bonds 10
Topological polar surface area 104.11
Molecular weight 359.15
XLogP 5.04
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
ethyl[2-(4-nitrophenoxy)ethyl][2-(4-nitrophenyl)ethyl]amine
Database Links
PubChem CID 86277846
Search Google for chemical match using the InChIKey DNTKZECWRGSWKD-UHFFFAOYSA-N
Search Google for chemicals with the same backbone DNTKZECWRGSWKD
Search UniChem for chemical match using the InChIKey DNTKZECWRGSWKD-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone DNTKZECWRGSWKD
Comments
The chemical structure shown here was drawn from [1]. LUF6200 acts as an inhibitory allosteric modulator of the human ether-à-go-go (hERG) K+ channel, with respect to astemizole and dofetilide, but displays positive co-operativity with K+ ions [1].