CHEMBL4107642


SMILES COCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5c4[C@@]2(CCN3C)[C@H]1O5
InChIKey HNFMRKGGZDJFSW-KBAKZFMASA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 7
Molecular weight (Da) 405.2

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 5.58 5.58 5.58 ChEMBL
κ OPRK Human Opioid A pKi 6.39 6.39 6.39 ChEMBL
μ OPRM Human Opioid A pKi 7.66 7.66 7.66 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Human Opioid A pEC50 6.19 6.19 6.19 ChEMBL
μ OPRM Human Opioid A pEC50 7.03 7.03 7.03 ChEMBL