UFP-505
SMILES | O=C(NCc1ccccc1)CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)[C@H](Cc1c(C)cc(cc1C)O)N |
InChIKey | SYOVEDOWOXNOJG-SVBPBHIXSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 4 |
Rotatable bonds | 8 |
Molecular weight (Da) | 514.3 |
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 |
μ | OPRM | Human | Opioid | A | pKi | 7.79 | 7.79 | 7.79 | Guide to Pharmacology |
δ | OPRD | Mouse | Opioid | A | pKd | 9.25 | 9.27 | 9.3 | ChEMBL |
μ | OPRM | Rat | Opioid | A | pKi | 9.8 | 9.8 | 9.8 | ChEMBL |
δ | OPRD | Human | Opioid | A | pKi | 10.51 | 10.51 | 10.51 | ChEMBL |
δ | OPRD | Human | Opioid | A | pKi | 9.82 | 9.82 | 9.82 | Guide to Pharmacology |
μ | OPRM | Human | Opioid | A | pKi | 9.8 | 9.8 | 9.8 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
δ | OPRD | Mouse | Opioid | A | pIC50 | 8.57 | 8.57 | 8.57 | ChEMBL |