CHEMBL4111803


SMILES COC(=O)COc1ccc(COC[C@H]2C[C@@]34CC[C@]2(OC)[C@@H]2Oc5c(OC)ccc6c5[C@@]23CCN(CC2CC2)[C@@H]4C6)cc1
InChIKey IEWGSARMLOQVFC-ASIKSVMXSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 0
Rotatable bonds 11
Molecular weight (Da) 589.3

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 6.13 6.13 6.13 ChEMBL
κ OPRK Human Opioid A pKi 7.92 7.92 7.92 ChEMBL
μ OPRM Human Opioid A pKi 7.72 7.72 7.72 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 6.11 6.11 6.11 ChEMBL
κ OPRK Human Opioid A pEC50 7.02 7.02 7.02 ChEMBL