CHEMBL2113378


SMILES CN1CC[C@]23c4c5ccc(O)c4O[C@H]2c2[nH]c4ccccc4c2C[C@@]3(NCCCc2ccccc2)C1C5
InChIKey YTWJWDDYBVMLGJ-ZCPWPLGKSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 5
Molecular weight (Da) 491.3

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 8.71 8.71 8.71 ChEMBL
κ OPRK Human Opioid A pKi 8.11 8.11 8.11 ChEMBL
μ OPRM Human Opioid A pKi 7.99 7.99 7.99 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 9.06 9.06 9.06 ChEMBL
κ OPRK Human Opioid A pEC50 7.57 7.57 7.57 ChEMBL
μ OPRM Human Opioid A pEC50 7.35 7.35 7.35 ChEMBL