CHEMBL1650848


SMILES CC1CN(c2nc3ccccc3n2C2CCN(C3(CO)CCCCCCC3)CC2)CCN1
InChIKey ZFBVHBCZNNALTI-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 439.3

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
NOP OPRX Human Opioid A pKi 9.02 9.02 9.02 ChEMBL
κ OPRK Human Opioid A pKi 6.56 6.56 6.56 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NOP OPRX Human Opioid A pEC50 7.42 7.42 7.42 ChEMBL
κ OPRK Human Opioid A pEC50 6.44 6.44 6.44 ChEMBL
μ OPRM Human Opioid A pEC50 5.75 5.75 5.75 ChEMBL