(+)-5-(5-bromothiophen-3-yl)-5-methyl-4-oxo-4,5-dihydro-furan-2-carboxylic acid
| SMILES | Brc1scc(c1)C1(C)OC(=CC1=O)C(=O)O |
| InChIKey | WJDLYZAOTHNUJX-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 2 |
| Molecular weight (Da) | 301.9 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Sankey plot
Compound is not listed as a drug.
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 |
| HCA2 | HCAR2 | Human | Hydroxycarboxylic acid | A | pEC50 | 7.3 | 7.3 | 7.3 | Guide to Pharmacology |
| HCA3 | HCAR3 | Human | Hydroxycarboxylic acid | A | pEC50 | 5.82 | 6.03 | 6.43 | ChEMBL |
| HCA2 | HCAR2 | Human | Hydroxycarboxylic acid | A | pEC50 | 6.96 | 7.08 | 7.32 | ChEMBL |