CHEMBL1766023


SMILES Nc1nc2cc3c(cc2s1)C[C@@H]1[C@@H]2CCCC[C@]32CCN1C[C@@H]1CCCO1
InChIKey NSXJCOLJLZPHDA-MMQADKFZSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 2
Molecular weight (Da) 383.2

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 7.25 7.25 7.25 ChEMBL
κ OPRK Human Opioid A pKi 9.08 9.08 9.08 ChEMBL
μ OPRM Human Opioid A pKi 8.62 8.62 8.62 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Human Opioid A pEC50 7.85 7.85 7.85 ChEMBL
μ OPRM Human Opioid A pEC50 7.15 7.15 7.15 ChEMBL