CHEMBL4644731


SMILES Cn1cc(-c2cnc3c(c2)C[C@@]2(OCCCc4ccccc4)[C@H]4Cc5ccc(O)c6c5[C@@]2(CCN4CC2CC2)[C@H]3O6)cn1
InChIKey QPPOEUPTBLXXKK-LMUOQGPPSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 8
Molecular weight (Da) 574.3

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 8.1 8.1 8.1 ChEMBL
κ OPRK Human Opioid A pKi 8.08 8.08 8.08 ChEMBL
μ OPRM Human Opioid A pKi 8.42 8.42 8.42 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pIC50 7.71 7.71 7.71 ChEMBL
μ OPRM Human Opioid A pEC50 6.18 6.18 6.18 ChEMBL