CHEMBL345820


SMILES COc1c(C(=O)NCCCCN2CCN(c3cccc(Cl)c3Cl)CC2)ccc2ccccc12
InChIKey JIFZJJHUCHFIGP-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 8
Molecular weight (Da) 485.2

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 6.08 6.08 6.08 ChEMBL
D3 DRD3 Rat Dopamine A pKi 9.22 9.22 9.22 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKi 5.29 5.29 5.29 ChEMBL
D4 DRD4 Human Dopamine A pKi 6.14 6.14 6.14 ChEMBL
D2 DRD2 Rat Dopamine A pKi 6.14 6.14 6.14 ChEMBL
5-HT1A 5HT1A Rat 5-Hydroxytryptamine A pKi 6.24 6.24 6.24 ChEMBL
D3 DRD3 Human Dopamine A pKi 9.22 9.22 9.22 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.08 6.08 6.08 ChEMBL
D3 DRD3 Human Dopamine A pKi 9.22 9.22 9.22 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database