CHEMBL322875


SMILES CC(C)=CC[C@@]12Cc3c([nH]c4ccccc34)[C@]3(C)Oc4c(O)ccc5c4[C@@]31CCN(C)C2C5
InChIKey MKCNXIXFBHSWPM-CAQJENOZSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 2
Molecular weight (Da) 440.2

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 7.29 7.29 7.29 ChEMBL
κ OPRK Human Opioid A pKi 6.36 6.36 6.36 ChEMBL
μ OPRM Human Opioid A pKi 6.59 6.59 6.59 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 7.04 7.04 7.04 ChEMBL
κ OPRK Human Opioid A pEC50 6.03 6.03 6.03 ChEMBL
μ OPRM Human Opioid A pEC50 5.92 5.92 5.92 ChEMBL