DADLE


SMILES Oc1ccc(cc1)C[C@@H](C(=O)N[C@@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C(=O)O)CC(C)C)Cc1ccccc1)C)N
InChIKey ZHUJMSMQIPIPTF-IBURTVSXSA-N
Sequence YAGFL

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 7
Rotatable bonds 15
Molecular weight (Da) 569.3

Drug properties

Molecular type Peptide
Physiological/Surrogate Surrogate
Approved drug Yes

Database connections

Structure pdb 9YDR 9YDP 9YDQ

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pKi 9.2 9.2 9.2 Guide to Pharmacology
μ OPRM Human Opioid A pKi 8.7 8.7 8.7 Guide to Pharmacology
δ OPRD Mouse Opioid A pKi 9.1 9.1 9.1 Guide to Pharmacology
δ OPRD Human Opioid A pKi 4.97 7.3 8.89 ChEMBL
δ OPRD Rat Opioid A pKi 8.11 8.85 9.59 ChEMBL
δ OPRD Rat Opioid A pKd 8.68 8.68 8.68 ChEMBL
μ OPRM Rat Opioid A pKi 7.82 8.0 8.09 ChEMBL
μ OPRM Rat Opioid A pKd 7.66 8.36 9.05 ChEMBL
κ OPRK Rat Opioid A pKd 6.2 6.2 6.2 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Mouse Opioid A pIC50 6.35 8.07 9.57 ChEMBL
δ OPRD Human Opioid A pEC50 5.21 7.69 10.7 ChEMBL
δ OPRD Human Opioid A pIC50 10.4 10.4 10.4 ChEMBL
δ OPRD Rat Opioid A pIC50 8.77 8.77 8.77 ChEMBL
μ OPRM Rat Opioid A pIC50 7.38 7.38 7.38 ChEMBL
μ OPRM Human Opioid A pEC50 5.86 6.21 6.89 ChEMBL
κ OPRK Guinea pig Opioid A pIC50 5.36 7.06 8.77 ChEMBL