CHEMBL3040800


SMILES COc1ccc2c(c1OCCNC[C@H]1COc3ccccc3O1)OCC2
InChIKey UOEUJVLYVLHEKQ-HNNXBMFYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 357.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α1D ADA1D Rat Adrenoceptors A pKd 9.58 9.58 9.58 ChEMBL
α1B ADA1B Rat Adrenoceptors A pKd 8.49 8.49 8.49 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 7.66 7.66 7.66 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKd 7.47 7.67 7.88 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 8.7 8.7 8.7 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 8.65 8.65 8.65 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 7.33 7.33 7.33 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database