CHEMBL474755


SMILES COc1ccc2c3c1O[C@H]1C(=O)CC[C@@]4(OC(=O)/C=C/c5ccccc5)[C@@H](C2)N(CC2CC2)CC[C@]314
InChIKey WGDLNMCFJZEUHA-ATTGEPADSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 6
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
δ OPRD Human Opioid A pKi 6.75 6.75 6.75 ChEMBL
κ OPRK Human Opioid A pKi 8.37 8.37 8.37 ChEMBL
μ OPRM Human Opioid A pKi 8.6 8.6 8.6 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 6.37 6.37 6.37 ChEMBL
κ OPRK Human Opioid A pEC50 7.58 7.58 7.58 ChEMBL
μ OPRM Human Opioid A pEC50 7.46 7.46 7.46 ChEMBL