Bioactive Compound Details

BioIDbio2595
NameAZILSARTAN
ChEMBL IDCHEMBL57242
Molecular FormulaC25H20N4O5
Molecular Weight456.46
Molecular Weight (Monoisotopic)456.1434
TypeSmall molecule
Max PhasePhase 3
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsAZILSARTAN|TAK-536
SmilesCCOc1nc2cccc(C(=O)O)c2n1Cc1ccc(-c2ccccc2-c2noc(=O)[nH]2)cc1
InchiInChI=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)
Inchi KeyKGSXMPPBFPAXLY-UHFFFAOYSA-N
Molecular SpeciesACID
Targets10.0
Bioactivities26.0
Np Likeness Score-0.88
Records Key['8e (TAK-536)', '2 (TAK-536)', 'Azilsartan (TAK-536)', 'AZILSARTAN', 'Azilsartan', 'AZILSARTAN', 'AZILSARTAN (TAK-536)', '104, TAK-536', 'Azilsartan (TAK-536)', 'Azilsartan (TAK-536)', 'AZILSARTAN', 'COVC-2297157972', 'Azilsartan']
Records Name[2-Ethoxy-3-[2'-(5-oxo-4,5-dihydro-[1,2,4]oxadiazol-3-yl)-biphenyl-4-ylmethyl]-3H-benzoimidazole-4-carboxylic acid", "2-Ethoxy-3-[2'-(5-oxo-4,5-dihydro-[1,2,4]oxadiazol-3-yl)-biphenyl-4-ylmethyl]-3H-benzoimidazole-4-carboxylic acid", 'Azilsartan (TAK-536)', 'AZILSARTAN', 'Azilsartan', 'AZILSARTAN', 'AZILSARTAN (TAK-536)', "2-ethoxy-1-((2'-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)biphenyl-4-yl)methyl)-1H-benzo[d]imidazole-7-carboxylic acid", 'Azilsartan (TAK-536)', 'Azilsartan (TAK-536)', 'AZILSARTAN', 'AZILSARTAN', 'Azilsartan']"
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure