CHEMBL4110642


SMILES COCCOCCOCCOCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5c4[C@@]2(CCN3C)[C@H]1O5
InChIKey HSENMLAGELTHPF-UEECTYCKSA-N

Chemical properties

Hydrogen bond acceptors 12
Hydrogen bond donors 2
Rotatable bonds 22
Molecular weight (Da) 625.3

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
δ OPRD Human Opioid A pKi 5.59 5.59 5.59 ChEMBL
κ OPRK Human Opioid A pKi 6.17 6.17 6.17 ChEMBL
μ OPRM Human Opioid A pKi 7.25 7.25 7.25 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Human Opioid A pEC50 5.37 5.37 5.37 ChEMBL
μ OPRM Human Opioid A pEC50 6.29 6.29 6.29 ChEMBL