CHEMBL340641


SMILES O=C(NCCCCN1CCN(c2ccc(Cl)cc2Cl)CC1)c1cc2ccccc2cn1
InChIKey BJILZOKLMRTDFN-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 456.1

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
α2A ADA2A Rat Adrenoceptors A pKi 5.98 5.98 5.98 ChEMBL
D3 DRD3 Rat Dopamine A pKi 9.18 9.18 9.18 ChEMBL
D1 DRD1 Rat Dopamine A pKi 5.11 5.11 5.11 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKi 6.2 6.2 6.2 ChEMBL
D2 DRD2 Rat Dopamine A pKi 6.47 6.47 6.47 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 5.98 5.98 5.98 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database