AZILSARTAN

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Synonyms
Status
Molecule Category Free-form
UNII F9NUX55P23
EPA CompTox DTXSID70163712

Structure

InChI Key KGSXMPPBFPAXLY-UHFFFAOYSA-N
Smiles CCOc1nc2cccc(C(=O)O)c2n1Cc1ccc(-c2ccccc2-c2noc(=O)[nH]2)cc1
InChI
InChI=1S/C25H20N4O5/c1-2-33-24-26-20-9-5-8-19(23(30)31)21(20)29(24)14-15-10-12-16(13-11-15)17-6-3-4-7-18(17)22-27-25(32)34-28-22/h3-13H,2,14H2,1H3,(H,30,31)(H,27,28,32)

Physicochemical Descriptors

Property Name Value
Molecular Formula C25H20N4O5
Molecular Weight 456.46
AlogP 4.6
Hydrogen Bond Acceptor 8.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 7.0
Polar Surface Area 123.5
Molecular species ACID
Aromatic Rings 5.0
Heavy Atoms 34.0

Pharmacology

Mechanism of Action Action Reference
Type-1 angiotensin II receptor antagonist ANTAGONIST PubMed PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Membrane receptor Family A G protein-coupled receptor Peptide receptor (family A GPCR) Short peptide receptor (family A GPCR) Angiotensin receptor
- 420 - - 100
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Bos taurus
- 420-420 - - -
Rattus norvegicus
- - - - 75-100

Target Conservation

Protein: Type-1 angiotensin II receptor
Description: Type-1 angiotensin II receptor
Organism : Homo sapiens
P30556 ENSG00000144891

Cross References

Resources Reference
ChEBI 68850
ChEMBL CHEMBL57242
FDA SRS F9NUX55P23
Guide to Pharmacology 6901
SureChEMBL SCHEMBL167538
ZINC ZINC000000598390
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