CHEMBL480426


SMILES CC1(N2CCC(n3c(-c4cccc(CN)c4)nc4ccccc43)CC2)CCCCCCC1
InChIKey VUWAQJRSLBBCLH-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 430.3

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 9.74 9.74 9.74 ChEMBL
δ OPRD Human Opioid A pKi 6.85 6.85 6.85 ChEMBL
κ OPRK Human Opioid A pKi 7.14 7.14 7.14 ChEMBL
μ OPRM Human Opioid A pKi 7.7 7.7 7.7 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NOP OPRX Human Opioid A pEC50 8.89 8.89 8.89 ChEMBL
κ OPRK Human Opioid A pEC50 6.81 6.81 6.81 ChEMBL
μ OPRM Human Opioid A pEC50 6.47 6.47 6.47 ChEMBL