CHEMBL4117594


SMILES Oc1ccc(CCN(CCc2cccc(O)c2)CC2CCCCC2)cc1
InChIKey UVCQRPUZCFWQTC-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 8
Molecular weight (Da) 353.2

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
δ OPRD Human Opioid A pKi 5.79 5.79 5.79 ChEMBL
κ OPRK Human Opioid A pKi 8.73 8.73 8.73 ChEMBL
μ OPRM Human Opioid A pKi 6.63 6.63 6.63 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Human Opioid A pEC50 7.65 7.65 7.65 ChEMBL