CHEMBL4109258


SMILES CO[C@]12CC[C@@]3(C[C@@H]1COCc1ccccc1)[C@H]1Cc4ccc(C(=O)O)c5c4[C@@]3(CCN1C)[C@H]2O5
InChIKey DRGUKZYCXDRQEJ-IPRXQQHWSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 6
Molecular weight (Da) 475.2

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
δ OPRD Human Opioid A pKi 4.87 4.87 4.87 ChEMBL
κ OPRK Human Opioid A pKi 8.26 8.26 8.26 ChEMBL
μ OPRM Human Opioid A pKi 7.27 7.27 7.27 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Human Opioid A pEC50 6.81 6.81 6.81 ChEMBL
μ OPRM Human Opioid A pEC50 6.2 6.2 6.2 ChEMBL