CHEMBL2112779


SMILES COc1cccc(C2CCC(N3CCN(c4ccccc4OC)CC3)CC2)c1
InChIKey ZNFGZJGKELODLV-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 5
Molecular weight (Da) 380.2

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 7.36 7.36 7.36 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 8.3 8.3 8.3 ChEMBL
α1D ADA1D Human Adrenoceptors A pKi 8.35 8.35 8.35 ChEMBL
D2 DRD2 Rat Dopamine A pKi 6.04 6.11 6.17 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 7.1 8.9 10.7 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 9.68 9.68 9.68 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database