CHEMBL1766036


SMILES CN(C)c1nc2cc3c(cc2s1)C[C@@H]1[C@@H]2CCCC[C@]32CCN1CC1CC1
InChIKey HXDNLAHUQMGSAY-XTQVGHSUSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 3
Molecular weight (Da) 381.2

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 7.19 7.19 7.19 ChEMBL
κ OPRK Human Opioid A pKi 9.35 9.35 9.35 ChEMBL
μ OPRM Human Opioid A pKi 8.0 8.0 8.0 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Human Opioid A pEC50 7.34 7.34 7.34 ChEMBL
μ OPRM Human Opioid A pEC50 6.85 6.85 6.85 ChEMBL