Bioactive Compound Details

BioIDbio2916
NameCANDESARTAN
ChEMBL IDCHEMBL1016
Molecular FormulaC24H20N6O3
Molecular Weight440.46
Molecular Weight (Monoisotopic)440.1597
TypeSmall molecule
Max PhasePhase 3
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsBLOPRESS|CANDEMORE|CANDESARTAN|CANDESARTAN CILEXETIL RELATED COMPOUND G|CV-11974|NSC-759858
SmilesCCOc1nc2cccc(C(=O)O)c2n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1
InchiInChI=1S/C24H20N6O3/c1-2-33-24-25-20-9-5-8-19(23(31)32)21(20)30(24)14-15-10-12-16(13-11-15)17-6-3-4-7-18(17)22-26-28-29-27-22/h3-13H,2,14H2,1H3,(H,31,32)(H,26,27,28,29)
Inchi KeyHTQMVQVXFRQIKW-UHFFFAOYSA-N
Molecular SpeciesACID
Targets193.0
Bioactivities1184.0
Np Likeness Score-1.13
Records Key['CANDESARTAN', 'Candesartan', 'CV-11974', '4 (CV-11974)', '26b (CV-11974)', '1a (CV-11974)', 'SID50112728', 'CANDESARTAN', 'CV-11974', 'Candesartan', 'candesartan', 'Candesartan', 'candesartan', '023, candesartan', 'Candesartan', 'candesartan', '2', 'Candesartan', '102, CV-11974', 'CANDESARTAN', 'Candesartan', 'SID144206031', '407', 'SID170466386', 'Candesartan', 'Candesartan', 'Candesartan', 'CANDESARTAN', 'CANDESARTAN', 'Candesartan', '22', 'Candesartan', 'CANDESARTAN', 'Candersartan', 'COVC-2285168508', '9', 'candesartan', 'candesartan', '[3H]-Candesartan', 'Candesartan', 'Candesartan', 'CANDESARTAN', 'CANDESARTAN', 'CANDESARTAN', '56', 'CANDESARTAN', 'CANDESARTAN', 'CANDESARTAN', 'Candesartan', 'CANDESARTAN', 'EUB0000863a', 'EUB0000863a', 'EUB0000863a', 'Candesartan', 'candesartan', 'BA1001058']
Records Name['CANDESARTAN', 2-Ethoxy-3-[2'-(2H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-3H-benzoimidazole-4-carboxylic acid", "2-Ethoxy-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-3H-benzoimidazole-4-carboxylic acid", "2-Ethoxy-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-3H-benzoimidazole-4-carboxylic acid", "2-Ethoxy-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-3H-benzoimidazole-4-carboxylic acid (CV-11974)", "2-Ethoxy-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-3H-benzoimidazole-4-carboxylic acid", 'SID50112728', 'Candesartan', "2-Ethoxy-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-3H-benzoimidazole-4-carboxylic acid", "2-Ethoxy-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-3H-benzoimidazole-4-carboxylic acid", 'candesartan', 'Candesartan', 'candesartan', "2-ethoxy-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-3H-benzoimidazole-4-carboxylic acid", "2-Ethoxy-3-[2'-(2H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-3H-benzoimidazole-4-carboxylic acid", 'candesartan', 'candesartan', 'Candesartan', "1-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)-2-ethoxy-1H-benzo[d]imidazole-7-carboxylic acid", 'CANDESARTAN', 'Candesartan', 'SID144206031', None, 'SID170466386', 'Candesartan', 'Candesartan', 'Candesartan', 'CANDESARTAN', 'CANDESARTAN', 'Candesartan', "2-Ethoxy-3-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-3H-benzoimidazole-4-carboxylic acid", 'Candesartan', 'CANDESARTAN', 'Candersartan', 'CANDESARTAN', 'Candesartan', 'candesartan', 'candesartan', '[3H]-Candesartan', 'Candesartan', 'Candesartan', 'CANDESARTAN', 'CANDESARTAN', 'CANDESARTAN', 'Candesartan', 'CANDESARTAN', 'CANDESARTAN', 'CANDESARTAN', 'Candesartan', 'CANDESARTAN', 'CANDESARTAN', 'CANDESARTAN', 'CANDESARTAN', 'Candesartan', 'candesartan', 'CANDESARTAN']"
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure