CHEMBL4108525


SMILES COCCOCCOCCOCCOCCOCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5c4[C@@]2(CCN3C)[C@H]1O5
InChIKey KRDZWSNJWKZJMK-WFNHTRGDSA-N

Chemical properties

Hydrogen bond acceptors 14
Hydrogen bond donors 2
Rotatable bonds 28
Molecular weight (Da) 713.4

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 5.24 5.24 5.24 ChEMBL
κ OPRK Human Opioid A pKi 5.9 5.9 5.9 ChEMBL
μ OPRM Human Opioid A pKi 6.95 6.95 6.95 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Human Opioid A pEC50 5.36 5.36 5.36 ChEMBL
μ OPRM Human Opioid A pEC50 5.97 5.97 5.97 ChEMBL