CHEMBL6195805


SMILES C[C@@H]1C[C@@H]2C[C@H](C1)C[C@H](N1[C@@H]3CCC[C@H]1C[C@@H](n1c(=O)c(P(=O)(O)O)nc4ccccc41)C3)C2
InChIKey AJXBAMWKPJMGCW-SZBYDGSXSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 3
Molecular weight (Da) 485.2

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
NOP OPRX Human Opioid A pKi 9.0 9.0 9.0 ChEMBL
δ OPRD Human Opioid A pKi 5.69 5.69 5.69 ChEMBL
μ OPRM Human Opioid A pKi 7.55 7.55 7.55 ChEMBL
κ OPRK Human Opioid A pKi 6.57 6.57 6.57 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NOP OPRX Human Opioid A pEC50 8.6 8.6 8.6 ChEMBL
μ OPRM Human Opioid A pEC50 4.7 4.7 4.7 ChEMBL
κ OPRK Human Opioid A pEC50 4.7 4.7 4.7 ChEMBL