CHEMBL2220898


SMILES COc1cccc(OC)c1OCCNC[C@H]1COc2c(OC)cccc2O1
InChIKey BPBCIZXGJQIHRC-AWEZNQCLSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 9
Molecular weight (Da) 375.2

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
α1A ADA1A Rat Adrenoceptors A pKd 7.27 7.33 7.4 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 7.62 7.62 7.62 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 6.35 6.35 6.35 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 7.1 7.1 7.1 ChEMBL
α1B ADA1B Rat Adrenoceptors A pKd 7.78 7.78 7.78 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 7.54 7.54 7.54 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database