CHEMBL3339378


SMILES O=C(NCc1ccccc1)C1=N[C@@]23CC[C@]1(O)C1Oc4c(O)ccc5c4C12CCN(CC1CC1)C3C5
InChIKey MMNHYWPAMYAKGY-SIOBRPEXSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 5
Molecular weight (Da) 485.2

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
μ OPRM Mouse Opioid A pKi 9.85 9.85 9.85 ChEMBL
δ OPRD Mouse Opioid A pKi 9.21 9.21 9.21 ChEMBL
κ OPRK Guinea pig Opioid A pKi 10.37 10.37 10.37 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 8.77 8.77 8.77 ChEMBL
κ OPRK Human Opioid A pEC50 10.48 10.48 10.48 ChEMBL
μ OPRM Human Opioid A pEC50 9.4 9.4 9.4 ChEMBL