CHEMBL3969063


SMILES N[C@@]1(C(=O)O)[C@H](OCc2ccc(Cl)c(Cl)c2)[C@@H](Sc2nc[nH]n2)[C@H]2[C@H](C(=O)O)[C@H]21
InChIKey QHBLXVIRCXAIGL-WNAOHANSSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 4
Rotatable bonds 7
Molecular weight (Da) 458.0

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
mGlu3 GRM3 Human Metabotropic glutamate C pKi 8.57 8.57 8.57 ChEMBL
mGlu2 GRM2 Human Metabotropic glutamate C pKi 8.13 8.13 8.13 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
mGlu3 GRM3 Human Metabotropic glutamate C pIC50 7.63 7.63 7.63 ChEMBL
mGlu2 GRM2 Human Metabotropic glutamate C pIC50 7.9 7.9 7.9 ChEMBL