Bioactive Compound Details

BioIDbio2830
NameEPROSARTAN
ChEMBL IDCHEMBL813
Molecular FormulaC23H24N2O4S
Molecular Weight424.52
Molecular Weight (Monoisotopic)424.1457
TypeSmall molecule
Max PhasePhase 4
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsEPROSARTAN|Eprosartan|SK&F 108566|SK&F-108566|SK-108566|TEVETEN|Teveten
SmilesCCCCc1ncc(/C=C(\Cc2cccs2)C(=O)O)n1Cc1ccc(C(=O)O)cc1
InchiInChI=1S/C23H24N2O4S/c1-2-3-6-21-24-14-19(12-18(23(28)29)13-20-5-4-11-30-20)25(21)15-16-7-9-17(10-8-16)22(26)27/h4-5,7-12,14H,2-3,6,13,15H2,1H3,(H,26,27)(H,28,29)/b18-12+
Inchi KeyOROAFUQRIXKEMV-LDADJPATSA-N
Molecular SpeciesACID
Targets105.0
Bioactivities195.0
Np Likeness Score-0.86
Records Key['eposartan', '1, SKF-108566', '2', '1', 'SKF-108566, Eprosartan', 'Eprosartan', '62', 'SKF-108566', 'Eprosartan', 'Eprosartan', '3, eprosartan', 'eprosartan', 'Eprosartan', '127', 'EPROSARTAN', 'Eprosartan', 'eprosartan', 'EPROSARTAN', 'Eprosartan', '2, SK&F-108566', 'eprosartan', 'Eprosartan', 'Eprosartan', 'EPROSARTAN', '976', 'Eprosartan', 'Eprosartan', 'EPROSARTAN', 'Eprosartan Mesylate', 'eprosartan']
Records Name['4-[2-Butyl-5-(2-carboxy-3-thiophen-2-yl-propenyl)-imidazol-1-ylmethyl]-benzoic acid', '4-[2-Butyl-5-(2-carboxy-3-thiophen-2-yl-propenyl)-imidazol-1-ylmethyl]-benzoic acid', '4-[2-Butyl-5-(2-carboxy-3-thiophen-2-yl-propenyl)-imidazol-1-ylmethyl]-benzoic acid', '4-[2-Butyl-5-((E)-2-carboxy-3-thiophen-2-yl-propenyl)-imidazol-1-ylmethyl]-benzoic acid', '4-[2-Butyl-5-((E)-2-carboxy-3-thiophen-2-yl-propenyl)-imidazol-1-ylmethyl]-benzoic acid', '4-[2-Butyl-5-(2-carboxy-3-thiophen-2-yl-propenyl)-imidazol-1-ylmethyl]-benzoic acid', '4-[2-Butyl-5-(2-carboxy-3-thiophen-2-yl-propenyl)-imidazol-1-ylmethyl]-benzoic acid', '4-[2-Butyl-5-((E)-2-carboxy-3-thiophen-2-yl-propenyl)-imidazol-1-ylmethyl]-benzoic acid', 'Eprosartan', 'Eprosartan', '4-((2-butyl-5-(2-carboxy-3-(thiophen-2-yl)prop-1-enyl)-1H-imidazol-1-yl)methyl)benzoic acid', 'eprosartan', 'Eprosartan', 'Eprosartan', 'EPROSARTAN', 'Eprosartan', 'eprosartan', 'EPROSARTAN', 'Eprosartan', 'Eprosartan', 'eprosartan', 'Eprosartan', 'Eprosartan', 'EPROSARTAN', None, 'Eprosartan', 'Eprosartan', 'EPROSARTAN', 'Eprosartan Mesylate', 'eprosartan']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure