Chembl610279


SMILES N=C(N)Nc1ccc2c3c([nH]c2c1)[C@@H]1Oc2c(O)ccc4c2[C@@]12CCN(CC1CC1)[C@H](C4)[C@]2(O)C3
InChIKey XDKOGAAFSBGLBO-GYHUNEDQSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 6
Rotatable bonds 3
Molecular weight (Da) 471.2

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
κ OPRK Rat Opioid A pKi 7.91 8.6 8.95 ChEMBL
δ OPRD Mouse Opioid A pKi 7.69 7.69 7.69 ChEMBL
μ OPRM Rat Opioid A pKi 7.09 7.09 7.09 ChEMBL
κ OPRK Human Opioid A pEC50 8.8 8.88 8.96 ChEMBL