AMILORIDE

Search structure
Synonyms:
Status: Approved (1981)
Entry Type: Small molecule
Molecule Category: Parent
ATC: C03DB01
UNII: 7DZO8EB0Z3

Structure
InChI Key XSDQTOBWRPYKKA-UHFFFAOYSA-N
Smile N=C(N)NC(=O)c1nc(Cl)c(N)nc1N
InChI
InChI=1S/C6H8ClN7O/c7-2-4(9)13-3(8)1(12-2)5(15)14-6(10)11/h(H4,8,9,13)(H4,10,11,14,15)

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H8ClN7O
Molecular Weight 229.63
AlogP -1.08
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 5.0
Number of Rotational Bond 1.0
Polar Surface Area 156.79
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 15.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Oxidoreductase
- - - 10000 -
Enzyme Protease Serine protease Serine protease PA clan Serine protease S1A subfamily
- 2400-11980 - 2433-7000 0-23
Ion channel Ligand-gated ion channel Acid-sensing ion channel
- 30200 - - 22-65
Ion channel Ligand-gated ion channel Epithelial sodium channel
- 776 - - 68
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Nucleotide-like receptor (family A GPCR) Adenosine receptor
- - - 3280-12000 -
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC09 family of sodium/hydrogen exchangers
- 60000-66730 - - -
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC22 family of organic cation and anion transporters
- 57000 - - 69
Unclassified protein
- 98000 - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Hypertension 3 D006973 ClinicalTrials
Optic Neuritis 2 D009902 ClinicalTrials
Demyelinating Diseases 2 D003711 ClinicalTrials
Coronary Disease 2 D003327 ClinicalTrials
Hyperparathyroidism, Primary 2 D049950 ClinicalTrials
Multiple Sclerosis, Chronic Progressive 2 D020528 ClinicalTrials
Migraine with Aura 2 D020325 ClinicalTrials
Cystic Fibrosis 1 D003550 ClinicalTrials
Attention Deficit Disorder with Hyperactivity 0 D001289 ClinicalTrials

Related Entries

Salt

Cross References

Resources Reference
CAS NUMBER 2609-46-3
ChEBI 2639
ChEMBL CHEMBL945
DrugBank DB00594
DrugCentral 158
EPA CompTox DTXSID9043853
FDA SRS 7DZO8EB0Z3
Human Metabolome Database HMDB0014732
Guide to Pharmacology 2421
KEGG C06821
PDB AMR
PharmGKB PA448368
PubChem 16231
SureChEMBL SCHEMBL27562
ZINC ZINC000004340269
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