CHEMBL519100


SMILES CC1(N2CCC(n3c(-c4cccc(C(F)(F)F)c4)nc4ccccc43)CC2)CCCCCCC1
InChIKey HQBSTEJSIZHCBP-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 3
Molecular weight (Da) 469.3

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 9.2 9.2 9.2 ChEMBL
δ OPRD Human Opioid A pKi 7.24 7.24 7.24 ChEMBL
κ OPRK Human Opioid A pKi 6.45 6.45 6.45 ChEMBL
μ OPRM Human Opioid A pKi 7.19 7.19 7.19 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NOP OPRX Human Opioid A pEC50 8.24 8.24 8.24 ChEMBL
κ OPRK Human Opioid A pEC50 5.8 5.8 5.8 ChEMBL
μ OPRM Human Opioid A pEC50 5.0 5.0 5.0 ChEMBL