CHEMBL1669153


SMILES Cc1cc(O)cc(C)c1C[C@@H](C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCC(=O)OC1=C2O[C@H]3[C@@H](O)C=C[C@H]4[C@H]5CC(C=C1)C2[C@@]34CCN5C)N(C)C
InChIKey RYHSGCXJLCXQNY-YBNMXXFDSA-N

Chemical properties

Hydrogen bond acceptors 9
Hydrogen bond donors 3
Rotatable bonds 9
Molecular weight (Da) 736.4

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 8.85 8.85 8.85 ChEMBL
κ OPRK Human Opioid A pKi 8.85 8.85 8.85 ChEMBL
μ OPRM Human Opioid A pKi 8.46 8.46 8.46 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pIC50 9.09 9.09 9.09 ChEMBL
κ OPRK Human Opioid A pEC50 7.7 7.7 7.7 ChEMBL
μ OPRM Human Opioid A pIC50 6.35 6.35 6.35 ChEMBL
μ OPRM Human Opioid A pEC50 7.54 7.54 7.54 ChEMBL