Chembl4780909


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

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 4
Molecular weight (Da) 388.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections


Bioactivity

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Rat Opioid A pKi 7.95 7.95 7.95 ChEMBL
κ OPRK Guinea pig Opioid A pKi 6.85 6.85 6.85 ChEMBL
μ OPRM Rat Opioid A pKi 8.83 8.83 8.83 ChEMBL
δ OPRD Human Opioid A pEC50 8.26 8.26 8.26 ChEMBL
κ OPRK Human Opioid A pEC50 6.0 6.0 6.0 ChEMBL
μ OPRM Human Opioid A pEC50 7.81 7.81 7.81 ChEMBL