CHEMBL222486


SMILES CCn1c2c(c3c1[C@@H]1Oc4c(O)ccc5c4[C@@]14CCN(CC1CC1)C(C5)[C@]4(O)C3)CCCC2
InChIKey KMIKXCSNMIPVHA-OZCDKMRVSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 3
Molecular weight (Da) 446.3

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 8.78 8.78 8.78 ChEMBL
κ OPRK Human Opioid A pKi 8.13 8.13 8.13 ChEMBL
μ OPRM Human Opioid A pKi 8.3 8.3 8.3 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 8.49 8.49 8.49 ChEMBL
κ OPRK Human Opioid A pEC50 7.84 7.84 7.84 ChEMBL