CHEMBL4530421


SMILES CC[C@@H]1CN2CC[C@]3(Nc4cccc(O)c4C3=O)[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC
InChIKey VJJRSIFBYURWHV-HMOBUCLISA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 4
Molecular weight (Da) 400.2

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
κ OPRK Mouse Opioid A pKi 6.77 6.77 6.77 ChEMBL
μ OPRM Mouse Opioid A pKi 8.85 8.85 8.85 ChEMBL
δ OPRD Mouse Opioid A pKi 8.21 8.21 8.21 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
μ OPRM Mouse Opioid A pEC50 8.7 8.7 8.7 ChEMBL
δ OPRD Mouse Opioid A pIC50 6.53 6.53 6.53 ChEMBL