CHEMBL519925


SMILES CC1CN(c2nc3ccccc3n2C2CCN(C3(C)CCCCCCC3)CC2)CC(C)N1
InChIKey IHDRRZZOAOZYJS-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 437.4

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 8.68 8.68 8.68 ChEMBL
κ OPRK Human Opioid A pKi 7.82 7.82 7.82 ChEMBL
μ OPRM Human Opioid A pKi 7.68 7.68 7.68 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NOP OPRX Human Opioid A pEC50 8.22 8.22 8.22 ChEMBL
κ OPRK Human Opioid A pEC50 7.75 7.75 7.75 ChEMBL
μ OPRM Human Opioid A pEC50 6.71 6.71 6.71 ChEMBL