CHEMBL415330


SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(N)=O
InChIKey YJLKYUMEUZAMMP-IWIISZHXSA-N

Chemical properties

Hydrogen bond acceptors None
Hydrogen bond donors None
Rotatable bonds None
Molecular weight (Da)

Drug properties

Molecular type Protein
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Rat Opioid A pKi 9.41 9.41 9.41 ChEMBL
κ OPRK Mouse Opioid A pKi 9.51 9.51 9.51 ChEMBL
δ OPRD Mouse Opioid A pKi 8.22 8.22 8.22 ChEMBL
κ OPRK Guinea pig Opioid A pKi 9.84 10.24 10.64 ChEMBL
μ OPRM Rat Opioid A pKi 8.73 9.28 9.71 ChEMBL
κ OPRK Human Opioid A pKi 9.4 9.4 9.4 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Mouse Opioid A pEC50 6.94 7.75 8.55 ChEMBL
κ OPRK Guinea pig Opioid A pIC50 9.94 9.94 9.94 ChEMBL
δ OPRD Human Opioid A pIC50 8.39 8.39 8.39 ChEMBL