CHEMBL286424


SMILES C=CCN1CCc2c(cc(O)c(O)c2Br)[C@H](c2ccccc2)C1
InChIKey KKZGFVAZUKHFAC-INIZCTEOSA-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
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Ligand site mutations D2

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D2 DRD2 Rat Dopamine A pKd 5.8 6.24 6.52 ChEMBL
D1 DRD1 Human Dopamine A pKd 6.42 6.42 6.42 ChEMBL
D1 DRD1 Human Dopamine A pKi 8.3 8.41 8.52 ChEMBL
D2 DRD2 Human Dopamine A pKi 4.68 6.29 7.72 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D1 DRD1 Rat Dopamine A pIC50 5.73 7.37 8.37 ChEMBL
M1 ACM1 Rat Acetylcholine (muscarinic) A Potency 4.75 4.85 4.95 ChEMBL
D2 DRD2 Rat Dopamine A pIC50 6.15 6.22 6.29 ChEMBL
TSH TSHR Human Glycoprotein hormone A Potency 5.1 5.1 5.1 ChEMBL