Bioactive Compound Details

BioIDbio2622
NameIMIDAFENACIN
ChEMBL IDCHEMBL53366
Molecular FormulaC20H21N3O
Molecular Weight319.41
Molecular Weight (Monoisotopic)319.1685
TypeSmall molecule
Max PhasePhase 3
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsIMIDAFENACIN|IMIDAFENACINA|IMIDAFENACINE|KRP-197|ONO-8025|STAYBLA|URITOS
SmilesCc1nccn1CCC(C(N)=O)(c1ccccc1)c1ccccc1
InchiInChI=1S/C20H21N3O/c1-16-22-13-15-23(16)14-12-20(19(21)24,17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-11,13,15H,12,14H2,1H3,(H2,21,24)
Inchi KeySQKXYSGRELMAAU-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets11.0
Bioactivities26.0
Np Likeness Score-0.71
Records Key['10', '1 (KRP-197)', '3982', '4b', 'IMIDAFENACIN', 'Imidafenacin', 'Imidafenacin', 'Imidafenacin脢', 'IMIDAFENACIN', 'Imidafenacin', 'IMIDAFENACIN', 'Imidafenacin', 'Imidafenacin脗', 'IMIDAFENACIN', 'Imidafenacin']
Records Name['4-(2-Methyl-imidazol-1-yl)-2,2-diphenyl-butyramide', '4-(2-Methyl-imidazol-1-yl)-2,2-diphenyl-butyramide', None, '4-(2-Methyl-imidazol-1-yl)-2,2-diphenyl-butyramide', 'IMIDAFENACIN', 'Imidafenacin', 'Imidafenacin', 'Imidafenacin脢', 'IMIDAFENACIN', 'Imidafenacin', 'IMIDAFENACIN', 'Imidafenacin', 'Imidafenacin脗', 'IMIDAFENACIN', 'Imidafenacin']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure