Bioactive Compound Details

BioIDbio2367
NameEMBUSARTAN
ChEMBL IDCHEMBL1742441
Molecular FormulaC25H24FN5O3
Molecular Weight461.5
Molecular Weight (Monoisotopic)461.1863
TypeSmall molecule
Max PhasePhase 2
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsEMBUSARTAN
SmilesCCCCc1cc(C(=O)OC)cc(=O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1F
InchiInChI=1S/C25H24FN5O3/c1-3-4-7-19-12-18(25(33)34-2)14-23(32)31(19)15-17-11-10-16(13-22(17)26)20-8-5-6-9-21(20)24-27-29-30-28-24/h5-6,8-14H,3-4,7,15H2,1-2H3,(H,27,28,29,30)
Inchi KeyLYVGOAYMIAQLHI-UHFFFAOYSA-N
Molecular SpeciesACID
TargetsNone
BioactivitiesNone
Np Likeness Score-1.17
Records Key['EMBUSARTAN']
Records Name['EMBUSARTAN']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure