CHEMBL3139302


SMILES Oc1ccc2c(c1)O[C@@H](CNCCN1CCN(c3ccc(I)cc3)CC1)CC2
InChIKey SLOWOAMUBQTOII-OAQYLSRUSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 6
Molecular weight (Da) 493.1

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
D5 DRD5 Human Dopamine A pKi 5.46 5.46 5.46 ChEMBL
D4 DRD4 Human Dopamine A pKi 8.01 8.02 8.02 ChEMBL
D1 DRD1 Human Dopamine A pKi 5.4 5.41 5.41 ChEMBL
D3 DRD3 Human Dopamine A pKi 7.64 7.65 7.66 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.88 7.04 7.18 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D2 DRD2 Human Dopamine A pEC50 8.8 8.8 8.8 ChEMBL