CHEMBL4551160


SMILES C[C@H]1CO[C@@H](c2ccc(N)nc2)CN1C[C@H]1C[C@@H]1CCNC(=O)c1cc2ccccc2[nH]1
InChIKey JQBHQHNVJCDNEL-SLHLXQHXSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 7
Molecular weight (Da) 433.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Structure pdb 9F33 9F34

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D4 DRD4 Human Dopamine A pKi 5.82 6.18 6.54 ChEMBL
D1 DRD1 Human Dopamine A pKi 5.25 5.25 5.25 ChEMBL
D3 DRD3 Human Dopamine A pKi 8.27 8.5 8.73 ChEMBL
μ OPRM Human Opioid A pKi 4.77 4.77 4.77 ChEMBL
D2 DRD2 Human Dopamine A pKi 5.79 6.42 7.06 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database