MAVOGLURANT

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Synonyms
Status
Molecule Category Free-form
UNII GT0I9SV4F6
EPA CompTox DTXSID30202777

Structure

InChI Key ZFPZEYHRWGMJCV-ZHALLVOQSA-N
Smiles COC(=O)N1CC[C@@H]2[C@H]1CCC[C@@]2(O)C#Cc1cccc(C)c1
InChI
InChI=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

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H23NO3
Molecular Weight 313.4
AlogP 2.72
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 1.0
Polar Surface Area 49.77
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 23.0

Pharmacology

Mechanism of Action Action Reference
Metabotropic glutamate receptor 5 antagonist ANTAGONIST PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Membrane receptor Family C G protein-coupled receptor Small molecule receptor (family C GPCR) Neurotransmitter receptor (family C GPCR) Metabotropic glutamate receptor
- 10-71.6 - 5.6-66 -
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Homo sapiens
- 10-71.6 - 5.6-10 -
Rattus norvegicus
- 51.6 - 66 -

Target Conservation

Protein: Metabotropic glutamate receptor 5
Description: Metabotropic glutamate receptor 5
Organism : Homo sapiens
P41594 ENSG00000168959

Cross References

Resources Reference
ChEMBL CHEMBL3087515
DrugBank DB13004
FDA SRS GT0I9SV4F6
Guide to Pharmacology 7586
PDB 2U8
SureChEMBL SCHEMBL989279
ZINC ZINC000003817189
CONTENTS