CHEMBL34095


SMILES C=CCN1CCc2c(cc(O)c(O)c2Br)[C@@H](c2ccccc2)C1
InChIKey KKZGFVAZUKHFAC-MRXNPFEDSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 3
Molecular weight (Da) 373.1

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D1 DRD1 Human Dopamine A pKi 8.52 8.52 8.52 ChEMBL
D1 DRD1 Human Dopamine A pKd 6.42 6.42 6.42 ChEMBL
D2 DRD2 Rat Dopamine A pKd 5.8 6.24 6.52 ChEMBL
D2 DRD2 Human Dopamine A pKi 6.46 6.46 6.46 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D1 DRD1 Rat Dopamine A pIC50 8.37 8.37 8.37 ChEMBL
D2 DRD2 Rat Dopamine A pIC50 6.29 6.29 6.29 ChEMBL