CHEMBL2089155


SMILES C[C@@H](Oc1ccccc1CC1CC1)C1=NCCN1
InChIKey SEKAQUSPSDPIAN-LLVKDONJSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 244.2

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
α2B ADA2B Human Adrenoceptors A pKi 6.47 6.47 6.47 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 6.63 6.63 6.63 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 7.35 7.35 7.35 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.4 7.4 7.4 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α2B ADA2B Human Adrenoceptors A pEC50 5.4 5.4 5.4 ChEMBL
α2C ADA2C Human Adrenoceptors A pEC50 6.5 6.5 6.5 ChEMBL