CHEMBL190785


SMILES COC(=O)[C@@H]1C[C@H](OC(=O)Nc2ccccc2)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C
InChIKey IHDOVLHHTAJFKU-XAGHGKQISA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 509.2

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
δ OPRD Human Opioid A pKi 6.64 6.64 6.64 ChEMBL
κ OPRK Human Opioid A pKi 7.03 7.03 7.03 ChEMBL
μ OPRM Human Opioid A pKi 7.8 7.8 7.8 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 5.6 5.6 5.6 ChEMBL
κ OPRK Human Opioid A pEC50 6.32 6.32 6.32 ChEMBL
μ OPRM Human Opioid A pEC50 6.23 6.23 6.23 ChEMBL