CHEMBL24035


SMILES C=CCN1CCN(C(c2ccccc2)c2ccc(C(=O)N(CC)CC)cc2)CC1
InChIKey PAIJMERJJOWHIB-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 8
Molecular weight (Da) 391.3

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
μ OPRM Rat Opioid A pKi 5.0 5.0 5.0 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Guinea pig Opioid A pIC50 5.7 5.7 5.7 ChEMBL
δ OPRD Human Opioid A pEC50 7.48 7.48 7.48 ChEMBL
δ OPRD Human Opioid A pIC50 7.8 8.13 8.39 ChEMBL
κ OPRK Human Opioid A pIC50 5.12 5.12 5.12 ChEMBL
μ OPRM Human Opioid A pIC50 5.3 5.3 5.3 ChEMBL