CHEMBL2367604


SMILES C[C@H]1[C@H]2Cc3ccc(O)cc3[C@@]1(C)CCN2C[C@@H]1CCCO1
InChIKey NLKLXMMOJZHSCB-IVJVFBROSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 2
Molecular weight (Da) 301.2

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 A0A286XTF2 Guinea pig Opioid A pKi 8.6 8.6 8.6 ChEMBL
κ OPRK Guinea pig Opioid A pKi 10.05 10.11 10.14 ChEMBL
δ OPRD Human Opioid A pKi 8.6 8.6 8.6 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Guinea pig Opioid A pIC50 8.77 8.77 8.77 ChEMBL
κ OPRK Human Opioid A pEC50 8.4 8.7 9.0 ChEMBL
μ OPRM Human Opioid A pIC50 7.77 7.77 7.77 ChEMBL
μ OPRM Human Opioid A pEC50 8.57 8.57 8.57 ChEMBL