Bioactive Compound Details

BioIDbio2407
NameRIPISARTAN
ChEMBL IDCHEMBL312104
Molecular FormulaC23H22N8O
Molecular Weight426.48
Molecular Weight (Monoisotopic)426.1917
TypeSmall molecule
Max PhasePhase 2
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsRIPISARTAN
SmilesCCCc1nc(C)n2[nH]c(=O)nc2c1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1
InchiInChI=1S/C23H22N8O/c1-3-6-20-19(22-25-23(32)28-31(22)14(2)24-20)13-15-9-11-16(12-10-15)17-7-4-5-8-18(17)21-26-29-30-27-21/h4-5,7-12H,3,6,13H2,1-2H3,(H,28,32)(H,26,27,29,30)
Inchi KeyOLJAPHMBAMBVKL-UHFFFAOYSA-N
Molecular SpeciesACID
Targets6.0
Bioactivities7.0
Np Likeness Score-0.94
Records Key['29 (UP 269-6)', 'UP-269-6', 'RIPISARTAN', '155, UP 269-6, UPSA']
Records Name[5-Methyl-7-propyl-8-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-[1,2,4]triazolo[1,5-c]pyrimidin-2-ol", "5-Methyl-7-propyl-8-[2'-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-3H-[1,2,4]triazolo[1,5-c]pyrimidin-2-ol", 'RIPISARTAN', "8-((2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl)-5-methyl-7-propyl-[1,2,4]triazolo[1,5-c]pyrimidin-2-ol"]"
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure