AMILORIDE HYDROCHLORIDE

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Trade Names
Synonyms
Status
Molecule Category Salt-form
UNII FZJ37245UC
EPA CompTox DTXSID80169826
Parent Compound: AMILORIDE

Structure

InChI Key LTKVFMLMEYCWMK-UHFFFAOYSA-N
Smiles Cl.N=C(N)NC(=O)c1nc(Cl)c(N)nc1N.O.O
InChI
InChI=1S/C6H8ClN7O.ClH.2H2O/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);1H;2*1H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H13Cl2N7O3
Molecular Weight 302.12
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

Mechanism of Action Action Reference
Amiloride-sensitive sodium channel, ENaC blocker BLOCKER PubMed PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - 51.46-65.11
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Cricetulus griseus
- - - - 51.46-65.11

Target Conservation

Protein: Amiloride-sensitive sodium channel, ENaC
Description: Amiloride-sensitive sodium channel subunit alpha
Organism : Homo sapiens
P37088 ENSG00000111319
Protein: Amiloride-sensitive sodium channel, ENaC
Description: Amiloride-sensitive sodium channel subunit beta
Organism : Homo sapiens
P51168 ENSG00000168447
Protein: Amiloride-sensitive sodium channel, ENaC
Description: Amiloride-sensitive sodium channel subunit gamma
Organism : Homo sapiens
P51170 ENSG00000166828

Cross References

Resources Reference
ChEBI 2640
ChEMBL CHEMBL1398126
FDA SRS FZJ37245UC
Guide to Pharmacology 2421
KEGG C06821
PDB AMR
PubChem 68540
SureChEMBL SCHEMBL41234
ZINC ZINC04340269
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