CHEMBL4799453
| SMILES | CC#C[C@@H](CC(=O)O)c1ccc(OCc2ccc(CN3CCC4(CC3)CC(=O)c3ccccc3O4)cc2)cc1 |
| InChIKey | CEVBGMGJZAYACN-MHZLTWQESA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 8 |
| Molecular weight (Da) | 523.2 |
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 |
| FFA1 | FFAR1 | Human | Free fatty acid | A | pKi | 7.8 | 7.8 | 7.8 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| FFA1 | FFAR1 | Mouse | Free fatty acid | A | pEC50 | 8.68 | 8.68 | 8.68 | ChEMBL |
| FFA1 | FFAR1 | Rat | Free fatty acid | A | pEC50 | 8.35 | 8.35 | 8.35 | ChEMBL |
| FFA1 | FFAR1 | Human | Free fatty acid | A | pEC50 | 7.19 | 7.62 | 8.08 | ChEMBL |