CHEMBL1926700


SMILES COc1ccccc1N1CCN(CCCNC(=O)c2cnn3ccc(OCCOCCOCCOCCOc4ccn5ncc(C(=O)NCCCN6CCN(c7ccccc7OC)CC6)c5c4)cc23)CC1
InChIKey SKOOZXVTNXFHFP-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 17
Hydrogen bond donors 2
Rotatable bonds 28
Molecular weight (Da) 976.5

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
D4 DRD4 Human Dopamine A pKi 7.29 7.29 7.29 ChEMBL
D2 DRD2 Human Dopamine A pKi 8.08 8.32 8.57 ChEMBL
D3 DRD3 Human Dopamine A pKi 8.46 8.46 8.46 ChEMBL
D1 DRD1 Pig Dopamine A pKi 5.89 5.89 5.89 ChEMBL
α1A Q9TSW7 Pig Adrenoceptors A pKi 8.39 8.39 8.39 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database