CHEMBL4587648


SMILES C=CCc1ccccc1OCC(O)CNCCOCCOCCOCCOCCN
InChIKey JTICSMPQQVDYOJ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 3
Rotatable bonds 21
Molecular weight (Da) 426.3

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
β2 ADRB2 Human Adrenoceptors A pKi 7.99 7.99 7.99 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 7.45 7.45 7.45 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
β2 ADRB2 Human Adrenoceptors A pIC50 7.0 7.0 7.0 ChEMBL