CHEMBL3597522
| SMILES | O=C(O)CCCc1cn(CC(=O)O)c2c(/C=C/c3ccc(OCCCCOc4ccccc4)cc3)cccc12 |
| InChIKey | NTBXOFAJPMVAEU-SAPNQHFASA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 15 |
| Molecular weight (Da) | 527.2 |
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 |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| CysLT2 | CLTR2 | Human | Leukotriene | A | pIC50 | 8.22 | 8.22 | 8.22 | ChEMBL |
| CysLT1 | CLTR1 | Human | Leukotriene | A | pIC50 | 8.82 | 8.82 | 8.82 | ChEMBL |