CHEMBL3799125


SMILES COc1ccccc1OCCNC[C@H](O)COc1cccc2[nH]c3ccccc3c12
InChIKey OGHNVEJMJSYVRP-KRWDZBQOSA-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
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Structure pdb 4AMJ 6PS3

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β1 ADRB1 Mouse Adrenoceptors A pKi 9.68 9.68 9.68 ChEMBL
β2 ADRB2 Human Adrenoceptors A pKi 10.47 10.5 10.52 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.31 7.31 7.31 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database