CHEMBL222704


SMILES CCn1c2c(c3c1[C@@H]1Oc4c(O)ccc5c4[C@@]14CCN(C)C(C5)[C@]4(O)C3)CCCC2
InChIKey JILRUXVVISWBOM-DYZJZLFBSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 1
Molecular weight (Da) 406.2

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
κ OPRK Human Opioid A pKi 6.78 6.78 6.78 ChEMBL
δ OPRD Human Opioid A pKi 8.57 8.57 8.57 ChEMBL
μ OPRM Human Opioid A pKi 7.59 7.59 7.59 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Human Opioid A pEC50 7.01 7.01 7.01 ChEMBL
δ OPRD Human Opioid A pEC50 7.99 7.99 7.99 ChEMBL
μ OPRM Human Opioid A pEC50 6.76 6.76 6.76 ChEMBL