CHEMBL13917


SMILES CCCc1ccccc1OCC1=NCCN1
InChIKey KJTFLBJQHBFQAF-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 5
Molecular weight (Da) 218.1

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
α2B ADA2B Human Adrenoceptors A pKi 6.26 6.26 6.26 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 6.31 6.31 6.31 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 7.31 7.31 7.31 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.1 7.1 7.1 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
α2B ADA2B Human Adrenoceptors A pEC50 5.6 5.6 5.6 ChEMBL
α2C ADA2C Human Adrenoceptors A pEC50 6.81 6.81 6.81 ChEMBL