CHEMBL5170301


SMILES O=C(CCc1ccccc1)N[C@H]1C[C@]23CCN(CC4CC4)[C@H](Cc4ccc(O)cc42)[C@]32CC[C@@H]1O2
InChIKey FJCPWHQOXLNSHQ-ONAGSAGBSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 6
Molecular weight (Da) 472.3

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 8.29 8.29 8.29 ChEMBL
κ OPRK Human Opioid A pKi 8.63 8.63 8.63 ChEMBL
μ OPRM Human Opioid A pKi 8.97 8.97 8.97 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 7.26 7.26 7.26 ChEMBL
κ OPRK Human Opioid A pEC50 8.2 8.2 8.2 ChEMBL
μ OPRM Human Opioid A pEC50 8.03 8.03 8.03 ChEMBL