CHEMBL3264745


SMILES C=CCN1CC[C@@]23c4c5ccc(O)c4OCO[C@]46CC[C@@]2(O[C@H](C(=O)N4Cc2ccccc2)[C@H]63)[C@H]1C5
InChIKey CPQZLWPWUDCRPX-HRPGWMCCSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 486.2

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
μ OPRM Mouse Opioid A pKi 7.17 7.17 7.17 ChEMBL
δ OPRD Mouse Opioid A pKi 8.91 8.91 8.91 ChEMBL
κ OPRK Guinea pig Opioid A pKi 7.25 7.25 7.25 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 8.19 8.45 8.7 ChEMBL
κ OPRK Human Opioid A pEC50 6.64 6.64 6.64 ChEMBL
μ OPRM Human Opioid A pEC50 8.29 8.43 8.57 ChEMBL