QX-314

Ligand id: 2405

Name: QX-314

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 29.1
Molecular weight 263.21
XLogP 3.08
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
[2-[(2,6-dimethylphenyl)amino]-2-oxoethyl]-triethylazanium
Database Links
CAS Registry No. 21306-56-9 (source: ChEBI)
ChEBI CHEBI:46937
ChEMBL Ligand CHEMBL1180496
PubChem CID 3925
Search Google for chemical match using the InChIKey PYEBKOFMWAMBFV-UHFFFAOYSA-O
Search Google for chemicals with the same backbone PYEBKOFMWAMBFV
Search UniChem for chemical match using the InChIKey PYEBKOFMWAMBFV-UHFFFAOYSA-O
Search UniChem for chemicals with the same backbone PYEBKOFMWAMBFV