CHEMBL2112774


SMILES COc1cccc(C2CCC(NCCOc3ccccn3)CC2)c1
InChIKey QEJVHQDLWUVNET-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 326.2

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
α1B ADA1B Human Adrenoceptors A pKi 6.48 6.48 6.48 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 6.7 6.7 6.7 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 6.85 6.85 6.85 ChEMBL
D2 DRD2 Rat Dopamine A pKi 6.11 6.17 6.23 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 6.43 7.1 7.77 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 8.42 8.42 8.42 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database