CHEMBL1940418


SMILES Fc1ccc(CCCCN2CCN(c3ccccn3)CC2)cc1
InChIKey NSMCYUMPIGJKHV-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 6
Molecular weight (Da) 313.2

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
D4 DRD4 Rat Dopamine A pKi 8.46 8.46 8.46 ChEMBL
D5 DRD5 Human Dopamine A pKi 5.84 5.84 5.84 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 6.51 6.51 6.51 ChEMBL
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 7.05 7.05 7.05 ChEMBL
H1 HRH1 Human Histamine A pKi 6.78 6.78 6.78 ChEMBL
D1 DRD1 Human Dopamine A pKi 6.62 6.62 6.62 ChEMBL
D4 DRD4 Human Dopamine A pKi 8.46 8.46 8.46 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 8.96 8.96 8.96 ChEMBL
5-HT2A 5HT2A Human 5-Hydroxytryptamine A pKi 7.3 7.3 7.3 ChEMBL
D3 DRD3 Human Dopamine A pKi 7.07 7.07 7.07 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.91 6.91 6.91 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database