CHEMBL55033


SMILES CCC12CCN(CC3CC3)C(C(=O)c3ccc(O)cc31)C2C
InChIKey SEJUQQOPVAUETF-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 299.2

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 A0A286XTF2 Guinea pig Opioid A pKi 8.47 8.47 8.47 ChEMBL
κ OPRK Guinea pig Opioid A pKi 6.73 8.38 9.21 ChEMBL
μ OPRM Rat Opioid A pKi 6.16 6.16 6.16 ChEMBL
δ OPRD Human Opioid A pKi 8.47 8.47 8.47 ChEMBL
κ OPRK Human Opioid A pKi 9.21 9.21 9.21 ChEMBL
μ OPRM Human Opioid A pKi 9.11 9.11 9.11 ChEMBL
μ OPRM Human Opioid A pKi 8.51 9.02 9.52 PDSP Ki database
δ OPRD Human Opioid A pKi 7.0 7.74 8.47 PDSP Ki database
κ OPRK Human Opioid A pKi 9.4 9.7 10.0 PDSP Ki database
κ OPRK Guinea pig Opioid A pKi 10.0 10.0 10.0 PDSP Ki database
δ A0A286XTF2 Guinea pig Opioid A pKi 8.7 8.7 8.7 PDSP Ki database
δ OPRD Rat Opioid A pKi 8.61 8.61 8.61 PDSP Ki database
μ OPRM Rat Opioid A pKi 8.71 8.71 8.71 PDSP Ki database
κ OPRK Rat Opioid A pKi 7.55 8.32 8.67 PDSP Ki database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database