CHEMBL31030


SMILES CO[C@]12C=CC3(CC14CCC(C)(C)[C@H]4O)C1Cc4ccc(O)c5c4C3(CCN1CC1CC1)[C@@H]2O5
InChIKey ZKAKTJKHXAIHBA-DDXVUPJYSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 3
Molecular weight (Da) 463.3

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 8.27 8.27 8.27 ChEMBL
κ OPRK Human Opioid A pKi 8.51 8.51 8.51 ChEMBL
μ OPRM Human Opioid A pKi 9.23 9.23 9.23 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 8.96 8.96 8.96 ChEMBL
κ OPRK Human Opioid A pEC50 10.0 10.0 10.0 ChEMBL
μ OPRM Human Opioid A pEC50 8.38 8.38 8.38 ChEMBL