5-(N,N-hexamethylene)-amiloride

Ligand id: 1192

Name: 5-(N,N-hexamethylene)-amiloride

Abbreviated name: HMA

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 3
Rotatable bonds 3
Topological polar surface area 136.51
Molecular weight 311.13
XLogP 0.68
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-amino-5-(azepan-1-yl)-6-chloro-N-(diaminomethylidene)pyrazine-2-carboxamide
Database Links
BindingDB Ligand 81818
ChEBI CHEBI:580303
ChEMBL Ligand CHEMBL501701
PubChem CID 1794
Search Google for chemical match using the InChIKey RQQJJXVETXFINY-UHFFFAOYSA-N
Search Google for chemicals with the same backbone RQQJJXVETXFINY
Search UniChem for chemical match using the InChIKey RQQJJXVETXFINY-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone RQQJJXVETXFINY