CHEMBL3786970


SMILES O=C1C[C@]23CCN(CC4CC4)[C@H](Cc4ccc(O)cc42)[C@]3(O)C/C1=C\c1ccccc1
InChIKey IGVCBUFJKDIFNJ-ZKAOPGHISA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 3
Molecular weight (Da) 415.2

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 8.56 8.56 8.56 ChEMBL
κ OPRK Human Opioid A pKi 7.41 7.41 7.41 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
δ OPRD Human Opioid A pEC50 7.9 7.9 7.9 ChEMBL
κ OPRK Human Opioid A pEC50 8.1 8.1 8.1 ChEMBL