CHEMBL3262362


SMILES CC[C@](O)([C@H]1C[C@@]23C=C[C@]1(OC)[C@@H]1Oc4c(O)ccc5c4[C@@]12CCN(CC1CC1)[C@@H]3C5)C(C)(C)C
InChIKey DCOQKCYIWZVJMA-DKMGXXMGSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 5
Molecular weight (Da) 479.3

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
NOP OPRX Human Opioid A pKi 6.73 6.73 6.73 ChEMBL
δ OPRD Human Opioid A pKi 8.92 8.92 8.92 ChEMBL
κ OPRK Human Opioid A pKi 9.12 9.12 9.12 ChEMBL
μ OPRM Human Opioid A pKi 8.38 8.38 8.38 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 6.5 6.5 6.5 ChEMBL
κ OPRK Human Opioid A pEC50 6.91 6.91 6.91 ChEMBL
μ OPRM Human Opioid A pEC50 6.62 6.62 6.62 ChEMBL