CHEMBL107207


SMILES COc1ccc2c(c1O)[C@]13CCN(C)C(C2)[C@@]12CC(=C(C)C)[C@@H]3c1[nH]c3ccccc3c1C2
InChIKey MKHNANMCTRPLDO-BXQCVQRUSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 1
Molecular weight (Da) 440.2

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 6.99 6.99 6.99 ChEMBL
κ OPRK Human Opioid A pKi 7.55 7.55 7.55 ChEMBL
μ OPRM Human Opioid A pKi 6.48 6.48 6.48 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pEC50 6.68 6.68 6.68 ChEMBL
κ OPRK Human Opioid A pEC50 6.06 6.06 6.06 ChEMBL
μ OPRM Human Opioid A pEC50 5.99 5.99 5.99 ChEMBL