enadoline


SMILES O=C(N([C@H]1CC[C@]2(C[C@@H]1N1CCCC1)CCCO2)C)Cc1cccc2c1cco2
InChIKey JMBYBVLCYODBJQ-HFMPRLQTSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 4
Molecular weight (Da) 396.2

Drug properties

Molecular type Small molecule
Endogenous/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 9.6 9.6 9.6 Guide to Pharmacology
κ OPRK Human Opioid A pKd 8.6 8.9 9.2 Guide to Pharmacology
μ OPRM Rat Opioid A pKi 7.06 7.06 7.06 ChEMBL
μ OPRM Human Opioid A pKi 7.66 7.66 7.66 ChEMBL
δ OPRD Human Opioid A pKi 6.0 6.0 6.0 PDSP Ki database
μ OPRM Human Opioid A pKi 7.66 7.66 7.66 PDSP Ki database
κ OPRK Human Opioid A pKi 9.57 9.57 9.57 PDSP Ki database
κ OPRK Human Opioid A pKi 9.57 9.57 9.57 ChEMBL
κ OPRK Rat Opioid A pKi 10.0 10.0 10.0 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Human Opioid A pEC50 8.48 8.48 8.48 ChEMBL