CHEMBL1650851


SMILES O=c1[nH]c2ccccc2n1C1CCN(C2(CO)CCCCCCC2)CC1
InChIKey IHTVZEPWUCPDDH-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 3
Molecular weight (Da) 357.2

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
NOP OPRX Human Opioid A pKi 8.37 8.37 8.37 ChEMBL
κ OPRK Human Opioid A pKi 6.62 6.62 6.62 ChEMBL
μ OPRM Human Opioid A pKi 7.8 7.8 7.8 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NOP OPRX Human Opioid A pEC50 7.43 7.43 7.43 ChEMBL
κ OPRK Human Opioid A pEC50 6.71 6.71 6.71 ChEMBL
μ OPRM Human Opioid A pEC50 6.84 6.84 6.84 ChEMBL