CHEMBL42539


SMILES COc1cccc(OC)c1OCCNCC1Oc2ccccc2OC1c1ccc(C)cc1
InChIKey UNHGFWKSHHCRHF-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 9
Molecular weight (Da) 435.2

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
α1A ADA1A Bovine Adrenoceptors A pKi 9.04 9.04 9.04 ChEMBL
α1D ADA1D Rat Adrenoceptors A pKi 7.93 7.93 7.93 ChEMBL
α1B ADA1B Rat Adrenoceptors A pKi 6.99 6.99 6.99 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 7.29 7.29 7.29 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKi 8.27 8.27 8.27 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 8.39 8.39 8.39 ChEMBL
D2 DRD2 Rat Dopamine A pKi 7.08 7.08 7.08 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 6.22 6.22 6.22 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.93 7.93 7.93 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database