CHEMBL4466677


SMILES COc1ccccc1N1CCN(CC2COCC(c3ccccc3)(c3ccccc3)O2)CC1
InChIKey FBWZMWVPZRCOTO-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 6
Molecular weight (Da) 444.2

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
α1B ADA1B Human Adrenoceptors A pKi 7.64 7.64 7.64 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 8.76 8.76 8.76 ChEMBL
D4 DRD4 Human Dopamine A pKi 5.86 5.86 5.86 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 8.58 8.58 8.58 ChEMBL
D3 DRD3 Human Dopamine A pKi 6.59 6.59 6.59 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 8.3 8.3 8.3 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.95 6.95 6.95 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database