quisqualate


SMILES OC(=O)[C@H](Cn1oc(=O)[nH]c1=O)N
InChIKey ASNFTDCKZKHJSW-REOHCLBHSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 3
Molecular weight (Da) 189.0

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug Yes

Database connections

Structure pdb 7FD8 7DGE 6N51 8T7H 8TAO 8T8M

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
mGlu1 GRM1 Rat Metabotropic glutamate C pKi 7.5 7.75 8.0 Guide to Pharmacology
mGlu1 GRM1 Rat Metabotropic glutamate C pKd 7.5 7.6 7.7 Guide to Pharmacology
mGlu3 GRM3 Human Metabotropic glutamate C pKi 4.4 4.4 4.4 ChEMBL
mGlu1 GRM1 Rat Metabotropic glutamate C pKi 8.0 8.0 8.0 ChEMBL
mGlu1 GRM1 Human Metabotropic glutamate C pKi 5.96 5.96 5.96 ChEMBL
mGlu5 GRM5 Human Metabotropic glutamate C pKi 7.26 7.26 7.26 ChEMBL
mGlu2 GRM2 Rat Metabotropic glutamate C pKi 5.0 5.0 5.0 PDSP Ki database
mGlu2 GRM2 Human Metabotropic glutamate C pKi 5.0 5.0 5.0 PDSP Ki database
mGlu3 GRM3 Human Metabotropic glutamate C pKi 5.0 5.0 5.0 PDSP Ki database
mGlu6 GRM6 Human Metabotropic glutamate C pKi 5.0 5.0 5.0 PDSP Ki database
mGlu5 GRM5 Human Metabotropic glutamate C pKi 5.0 5.77 7.32 PDSP Ki database
mGlu5 GRM5 Rat Metabotropic glutamate C pKi 5.0 5.61 6.82 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
mGlu5 GRM5 Rat Metabotropic glutamate C pIC50 7.5 7.5 7.5 Guide to Pharmacology
mGlu3 GRM3 Rat Metabotropic glutamate C pEC50 4.4 4.4 4.4 ChEMBL
mGlu1 GRM1 Rat Metabotropic glutamate C pEC50 4.79 5.87 6.7 ChEMBL
mGlu1 GRM1 Human Metabotropic glutamate C pEC50 6.7 6.7 6.7 ChEMBL
M1 ACM1 Rat Acetylcholine (muscarinic) A Potency 7.75 7.75 7.75 ChEMBL
mGlu5 GRM5 Rat Metabotropic glutamate C pEC50 6.52 6.64 6.7 ChEMBL
mGlu5 GRM5 Human Metabotropic glutamate C pEC50 6.2 6.51 6.82 ChEMBL