Bioactive Compound Details

BioIDbio44684
NameNAVOXIMOD
ChEMBL IDCHEMBL3989951
Molecular FormulaC18H21FN2O2
Molecular Weight316.38
Molecular Weight (Monoisotopic)316.1587
TypeSmall molecule
Max PhasePhase 2
Target IDTar10
Target NameP2X purinoceptor 7 (P2RX7)
SynonymsGDC-0919|IDO-IN-7|NAVOXIMOD|NLG-919|NLG919|RG-6078|RG6078|RO-7077339|RO7077339|RO7077339-001
SmilesO[C@H](C[C@H]1c2c(F)cccc2-c2cncn21)[C@H]1CC[C@H](O)CC1
InchiInChI=1S/C18H21FN2O2/c19-14-3-1-2-13-16-9-20-10-21(16)15(18(13)14)8-17(23)11-4-6-12(22)7-5-11/h1-3,9-12,15,17,22-23H,4-8H2/t11-,12-,15-,17+/m0/s1
Inchi KeyYGACXVRLDHEXKY-WXRXAMBDSA-N
Molecular SpeciesNEUTRAL
Targets17.0
Bioactivities126.0
Np Likeness Score0.05
Records Key['NAVOXIMOD', 'NLG-919', '15; NLG919', 'GDC-0919', 'NAVOXIMOD', 'NLG-919', '3; GDC-0919', 'Navoximod', 'Navoximod', '1', 'Navoximod', 'GDC-0919', 'NLG-919']
Records Name['NAVOXIMOD', '(1R,4r)-4-((R)-2-((S)-6-fluoro-5H-imidazo[5,1-a]isoindol-5-yl)-1-hydroxyethyl)cyclohexanol', 'Navoximod', '4-[(1R)-2-[(5S)-6-fluoro-5H-imidazo[1,5-b]isoindol-5-yl]-1-hydroxy-ethyl]cyclohexanol', 'NAVOXIMOD', 'Navoximod; (1R,4r)-4-((R)-2-((S)-6-Fluoro-5H-imidazo[5,1-a]isoindol-5-yl)-1-hydroxyethyl)cyclohexan-1-ol', 'Navoximod', 'Navoximod', 'Navoximod', 'Navoximod', 'Navoximod', 'Navoximod; (1r,4r)-4-((R)-2-((S)-6-Fluoro-5H-imidazo[5,1-a]isoindol-5-yl)-1-hydroxyethyl)cyclohexan-1-ol', 'Navoximod']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure