carvedilol


SMILES COc1ccccc1OCCNCC(COc1cccc2c1c1ccccc1[nH]2)O
InChIKey OGHNVEJMJSYVRP-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 10
Molecular weight (Da) 406.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug Yes

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
mGlu5 GRM5 Human Metabotropic glutamate C pKi 8.42 8.42 8.42 Guide to Pharmacology
mGlu5 GRM5 Rat Metabotropic glutamate C pKd 8.03 8.03 8.03 ChEMBL
mGlu5 GRM5 Human Metabotropic glutamate C pKd 8.14 8.37 8.65 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
mGlu5 GRM5 Human Metabotropic glutamate C pIC50 8.12 8.12 8.12 Guide to Pharmacology
mGlu5 GRM5 Rat Metabotropic glutamate C pIC50 8.59 8.59 8.59 ChEMBL
mGlu5 GRM5 Human Metabotropic glutamate C pIC50 7.58 7.85 8.12 ChEMBL