DELTORPHIN II
SMILES | CC(C)[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)NCC(N)=O)C(C)C |
InChIKey | NUNBRHVOPFWRRG-RCEFDBTISA-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
Structure pdb | 8F7S |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
μ | OPRM | Rat | Opioid | A | pKi | 6.3 | 6.3 | 6.3 | ChEMBL |
δ | OPRD | Human | Opioid | A | pKi | 8.89 | 8.89 | 8.89 | ChEMBL |
μ | OPRM | Human | Opioid | A | pKi | 5.68 | 6.11 | 6.64 | PDSP Ki database |
δ | OPRD | Human | Opioid | A | pKi | 8.48 | 8.94 | 9.51 | PDSP Ki database |
κ | OPRK | Human | Opioid | A | pKi | 5.0 | 5.5 | 6.0 | PDSP Ki database |
κ | OPRK | Guinea pig | Opioid | A | pKi | 5.0 | 5.0 | 5.0 | PDSP Ki database |
δ | OPRD | Rat | Opioid | A | pKi | 5.93 | 6.62 | 7.32 | PDSP Ki database |
δ | A0A286XTF2 | Guinea pig | Opioid | A | pKi | 5.54 | 5.54 | 5.54 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
δ | OPRD | Mouse | Opioid | A | pIC50 | 9.43 | 9.43 | 9.43 | ChEMBL |
δ | OPRD | Human | Opioid | A | pEC50 | 7.96 | 8.03 | 8.1 | ChEMBL |
μ | OPRM | Human | Opioid | A | pEC50 | 5.71 | 5.71 | 5.71 | ChEMBL |