CHEMBL1672084


SMILES CO[C@@]12CC[C@H](NCC(=O)O)[C@@H]3Oc4c(O)ccc5c4[C@@]31CCN(C)[C@@H]2C5
InChIKey YHKUQEWICWSOTO-BSCZKGNESA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 4
Molecular weight (Da) 374.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Guinea pig Opioid A pKi 7.37 7.37 7.37 ChEMBL
μ OPRM Rat Opioid A pKi 9.05 9.05 9.05 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 8.02 8.02 8.02 ChEMBL
κ OPRK Human Opioid A pEC50 6.4 6.4 6.4 ChEMBL
μ OPRM Human Opioid A pEC50 8.94 8.94 8.94 ChEMBL