Chembl3339379


SMILES O=C(NCCc1ccccc1)C1=N[C@@]23CC[C@]1(O)C1Oc4c(O)ccc5c4C12CCN(CC1CC1)C3C5
InChIKey HKIHGXVMQLQUIN-LBWTYPISSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 6
Molecular weight (Da) 499.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections


Bioactivity

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
μ OPRM Mouse Opioid A pKi 9.4 9.4 9.4 ChEMBL
δ OPRD Mouse Opioid A pKi 9.07 9.07 9.07 ChEMBL
κ OPRK Guinea pig Opioid A pKi 9.92 9.92 9.92 ChEMBL
κ OPRK Human Opioid A pEC50 9.74 9.74 9.74 ChEMBL
μ OPRM Human Opioid A pEC50 8.96 8.96 8.96 ChEMBL