CHEMBL416765


SMILES CO[C@]12C=CC3(CC14CCC[C@H]4O)C1Cc4ccc(O)c5c4C3(CCN1C)[C@@H]2O5
InChIKey VAGUZCYSBGOWIA-RQLPUAOISA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 1
Molecular weight (Da) 395.2

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 8.26 8.26 8.26 ChEMBL
κ OPRK Human Opioid A pKi 9.06 9.06 9.06 ChEMBL
μ OPRM Human Opioid A pKi 9.59 9.59 9.59 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 8.21 8.21 8.21 ChEMBL
κ OPRK Human Opioid A pEC50 7.98 7.98 7.98 ChEMBL
μ OPRM Human Opioid A pEC50 8.43 8.43 8.43 ChEMBL