MRS1476
| SMILES | CCOC(=O)c1c(nc(c(c1CC)C(=O)SCC)CC)c1ccccc1 |
| InChIKey | WYZGZKCWULQWSH-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 7 |
| Molecular weight (Da) | 371.2 |
Drug properties
| Molecular type | Small molecule |
| Endogenous/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| δ | OPRD | Human | Opioid | A | pKi | 6.97 | 6.97 | 6.97 | Guide to Pharmacology |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| δ | OPRD | Human | Opioid | A | pIC50 | 9.05 | 9.05 | 9.05 | Guide to Pharmacology |
| κ | OPRK | Human | Opioid | A | pIC50 | 5.13 | 5.13 | 5.13 | Guide to Pharmacology |
| μ | OPRM | Human | Opioid | A | pIC50 | 5.42 | 5.42 | 5.42 | Guide to Pharmacology |
| δ | OPRD | Human | Opioid | A | pEC50 | 8.14 | 8.14 | 8.14 | ChEMBL |
| δ | OPRD | Human | Opioid | A | pIC50 | 9.06 | 9.06 | 9.06 | ChEMBL |
| κ | OPRK | Human | Opioid | A | pIC50 | 5.13 | 5.13 | 5.13 | ChEMBL |
| μ | OPRM | Human | Opioid | A | pIC50 | 5.42 | 5.42 | 5.42 | ChEMBL |