Bioactive Compound Details

BioIDbio3258
NameMAVOGLURANT
ChEMBL IDCHEMBL3087515
Molecular FormulaC19H23NO3
Molecular Weight313.4
Molecular Weight (Monoisotopic)313.1678
TypeSmall molecule
Max PhasePhase 2
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
SynonymsAFQ-056|AFQ056|MAVOGLURANT|Mavoglurant
SmilesCOC(=O)N1CC[C@@H]2[C@H]1CCC[C@@]2(O)C#Cc1cccc(C)c1
InchiInChI=1S/C19H23NO3/c1-14-5-3-6-15(13-14)8-11-19(22)10-4-7-17-16(19)9-12-20(17)18(21)23-2/h3,5-6,13,16-17,22H,4,7,9-10,12H2,1-2H3/t16-,17-,19-/m1/s1
Inchi KeyZFPZEYHRWGMJCV-ZHALLVOQSA-N
Molecular SpeciesNEUTRAL
Targets8.0
Bioactivities16.0
Np Likeness Score0.18
Records Key['1, AFQ-056', 'MAVOGLURANT', '2; mavoglurant', 'Mavoglurant', 'MAVOGLURANT', 'MAVOGLURANT', '1', 'Mavoglurant', 'Mavoglurant']
Records Name['Mavoglurant', 'MAVOGLURANT', 'methyl (3aR,4S,7aR)-4-hydroxy-4-[(3-methylphenyl)ethynyl]octahydro-1H-indole-1-carboxylate', 'Mavoglurant', 'MAVOGLURANT', 'MAVOGLURANT', 'mavoglurant', 'Mavoglurant', 'Mavoglurant']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure