CHEMBL3786083


SMILES O=C1C[C@]23CCN(CC4CC4)[C@H](Cc4ccc(O)cc42)[C@]3(O)CC/C1=C/c1ccccc1
InChIKey KPNWEHZMMBQVLY-LEAAFYOASA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 3
Molecular weight (Da) 429.2

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
δ OPRD Human Opioid A pKi 8.01 8.01 8.01 ChEMBL
κ OPRK Human Opioid A pKi 7.76 7.76 7.76 ChEMBL
μ OPRM Human Opioid A pKi 7.28 7.28 7.28 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 8.74 8.74 8.74 ChEMBL
κ OPRK Human Opioid A pEC50 7.67 7.67 7.67 ChEMBL
μ OPRM Human Opioid A pEC50 7.72 7.72 7.72 ChEMBL