CHEMBL4803381
| SMILES | Cc1cc(SC[C@@H]2[C@@H](O)[C@@H]3[C@@H]([C@H]3C(=O)O)[C@]2(N)C(=O)O)ccc1F |
| InChIKey | XBQXBDVFZNVFIQ-WVXSZGNASA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 4 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 355.1 |
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 |
| mGlu3 | GRM3 | Human | Metabotropic glutamate | C | pKi | 8.23 | 8.23 | 8.23 | ChEMBL |
| mGlu2 | GRM2 | Human | Metabotropic glutamate | C | pKi | 8.05 | 8.05 | 8.05 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| mGlu3 | GRM3 | Human | Metabotropic glutamate | C | pIC50 | 7.57 | 7.57 | 7.57 | ChEMBL |
| mGlu2 | GRM2 | Human | Metabotropic glutamate | C | pIC50 | 7.76 | 7.76 | 7.76 | ChEMBL |