CHEMBL377789


SMILES C[C@H]1C2Cc3ccc(C(=O)NCCc4ccc(-c5ccccc5)cc4)cc3[C@@]1(C)CCN2CC1CC1
InChIKey GZDNGLGWJBOMSN-CHCCDMOGSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 478.3

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 9.13 9.13 9.13 ChEMBL
κ OPRK Human Opioid A pKi 8.74 8.74 8.74 ChEMBL
μ OPRM Human Opioid A pKi 9.52 9.52 9.52 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 8.52 8.52 8.52 ChEMBL
κ OPRK Human Opioid A pEC50 8.36 8.47 8.52 ChEMBL
μ OPRM Human Opioid A pIC50 6.82 6.82 6.82 ChEMBL