CHEMBL2113377


SMILES CCCCN[C@@]12Cc3c([nH]c4ccccc34)[C@@H]3Oc4c(O)ccc5c4[C@@]31CCN(C)C2C5
InChIKey ZLCHACBECUMKAL-SSNGLDLMSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 4
Molecular weight (Da) 429.2

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 8.86 8.86 8.86 ChEMBL
κ OPRK Human Opioid A pKi 7.44 7.44 7.44 ChEMBL
μ OPRM Human Opioid A pKi 7.43 7.43 7.43 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 8.33 8.33 8.33 ChEMBL
κ OPRK Human Opioid A pEC50 6.03 6.03 6.03 ChEMBL
μ OPRM Human Opioid A pEC50 6.57 6.57 6.57 ChEMBL