ELQ-300

Ligand id: 10021

Name: ELQ-300

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 60.55
Molecular weight 475.08
XLogP 8.16
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Ligand families/groups Antimalarial ligands
IUPAC Name
6-chloro-7-methoxy-2-methyl-3-[4-[4-(trifluoromethoxy)phenoxy]phenyl]-1H-quinolin-4-one
Synonyms
ELQ300
Comments
ELQ-300 is a late lead candidate from a novel class of 4(1H)-quinolone-based compounds with potent antimalarial activity [4]. The ELQs (endochin-like quinolones) are structural derivatives of endochin (PubChem CID 100474), which has potent antiplasmodial activity, but is highly metabolically unstable in mammals [1,6].

The Malaria tab on this ligand page provides additional curator comments of relevance to the Guide to MALARIA PHARMACOLOGY.
Database Links
CAS Registry No. 1354745-52-0 (source: PubChem)
ChEMBL Ligand CHEMBL2431810
GtoPdb PubChem SID 375973211
PubChem CID 67016608
Search Google for chemical match using the InChIKey WZDNKHCQIZRDKW-UHFFFAOYSA-N
Search Google for chemicals with the same backbone WZDNKHCQIZRDKW
Search UniChem for chemical match using the InChIKey WZDNKHCQIZRDKW-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone WZDNKHCQIZRDKW