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

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
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
mGlu5 GRM5 Rat Metabotropic glutamate C pIC50 7.5 7.5 7.5 Guide to Pharmacology