Chembl4249256


SMILES COc1ccc2c3c1O[C@@H]1[C@]34CCN(CC3CC3)[C@H](C2)[C@]42C=C[C@@]1(OC)[C@@H](C(=O)c1ccccc1)C2
InChIKey JZVUAKBCTNDAJX-NPBSHTHCSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 6
Molecular weight (Da) 483.2

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 pEC50 6.17 6.17 6.17 ChEMBL
μ OPRM Rat Opioid A pEC50 6.88 6.88 6.88 ChEMBL
δ OPRD Human Opioid A pKi 6.11 6.11 6.11 ChEMBL
κ OPRK Human Opioid A pEC50 9.0 9.0 9.0 ChEMBL
κ OPRK Human Opioid A pKi 9.4 9.4 9.4 ChEMBL
μ OPRM Human Opioid A pKi 6.89 6.89 6.89 ChEMBL