CHEMBL388564


SMILES COc1cc2c(c(Br)c1O)C[C@H]1c3c(c(Br)c(O)c(OC)c3-2)CCN1C
InChIKey FTUCKVYWXINSAK-NSHDSACASA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 2
Molecular weight (Da) 483.0

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
α1B ADA1B Rat Adrenoceptors A pKi 6.92 6.92 6.92 ChEMBL
α1A ADA1A Rat Adrenoceptors A pKi 8.87 8.87 8.87 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
D1 DRD1 Rat Dopamine A pIC50 6.69 6.69 6.69 ChEMBL
D2 DRD2 Rat Dopamine A pIC50 5.72 5.72 5.72 ChEMBL