CHEMBL1916548


SMILES CCCN(CCCCNC(=O)c1ccc(OCCCc2cn(CCCCCCCCn3cc(CCCOc4ccc(CN5CCN(c6ccccc6OC)CC5)cc4OC)nn3)nn2)c(OC)c1)C1Cc2ccccc2C1
InChIKey WMJCLJNBELMTPC-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 15
Hydrogen bond donors 1
Rotatable bonds 34
Molecular weight (Da) 1052.7

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
D1 DRD1 Pig Dopamine A pKi 6.48 6.48 6.48 ChEMBL
D4 DRD4 Human Dopamine A pKi 7.66 7.66 7.66 ChEMBL
D3 DRD3 Human Dopamine A pKi 8.92 8.92 8.92 ChEMBL
D2 DRD2 Human Dopamine A pKi 7.85 7.96 8.06 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D2 DRD2 Human Dopamine A pEC50 6.42 6.42 6.42 ChEMBL