CHEMBL1928121


SMILES COc1ccccc1N1CCN(CCCNC(=O)c2cccc(OCCOCCOCCOCCOc3cccc(C(=O)NCCCN4CCN(c5ccccc5OC)CC4)c3)c2)CC1
InChIKey HFOIDKHQFBQZMF-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 13
Hydrogen bond donors 2
Rotatable bonds 28
Molecular weight (Da) 896.5

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
α1A Q9TSW7 Pig Adrenoceptors A pKi 8.85 8.85 8.85 ChEMBL
D1 DRD1 Pig Dopamine A pKi 6.6 6.6 6.6 ChEMBL
D4 DRD4 Human Dopamine A pKi 7.42 7.42 7.42 ChEMBL
D3 DRD3 Human Dopamine A pKi 7.96 7.96 7.96 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.8 7.99 8.19 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database