Bioactive Compound Details

BioIDbio2894
NameFACINICLINE
ChEMBL IDCHEMBL2151439
Molecular FormulaC15H18N4O
Molecular Weight270.34
Molecular Weight (Monoisotopic)270.1481
TypeSmall molecule
Max PhasePhase 2
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsFACINICLINE|MEM 3454 FREE BASE|MEM-3454 FREE BASE|MEM3454 FREE BASE|RG-3487 FREE BASE|RG3487 FREE BASE|RO-5313534 FREE BASE
SmilesO=C(N[C@@H]1CN2CCC1CC2)c1n[nH]c2ccccc12
InchiInChI=1S/C15H18N4O/c20-15(14-11-3-1-2-4-12(11)17-18-14)16-13-9-19-7-5-10(13)6-8-19/h1-4,10,13H,5-9H2,(H,16,20)(H,17,18)/t13-/m1/s1
Inchi KeyTXCYUSKWBHUVEP-CYBMUJFWSA-N
Molecular SpeciesNEUTRAL
Targets5.0
Bioactivities14.0
Np Likeness Score-1.02
Records Key['20, RG3487, MEM3454']
Records Name['N-[(3S)-1-Azabicyclo[2.2.2]oct-3-yl]-1H-indazole-3-carboxamide']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure