CHEMBL574534


SMILES COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(-c3cn(Cc4ccc(-c5ccc(Cn6cc(-c7ccc(C(=O)NCCCCN8CCN(c9ccccc9OC)CC8)cc7)nn6)cc5)cc4)nn3)cc2)CC1
InChIKey KEOJOHYWCQCCER-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 14
Hydrogen bond donors 2
Rotatable bonds 23
Molecular weight (Da) 1046.6

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
5-HT2A 5HT2A Pig 5-Hydroxytryptamine A pKi 5.77 5.77 5.77 ChEMBL
D4 DRD4 Human Dopamine A pKi 6.07 6.07 6.07 ChEMBL
D3 DRD3 Human Dopamine A pKi 7.16 7.16 7.16 ChEMBL
D2 DRD2 Human Dopamine A pKi 5.7 5.91 6.11 ChEMBL
D1 DRD1 Pig Dopamine A pKi 5.02 5.02 5.02 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database