CHEMBL1084799
| SMILES | C[C@H]1CC(NC(=O)CCc2nc(-c3ccc(F)cn3)no2)=C(C(=O)O)C[C@H]1c1cc(F)cc(F)c1F |
| InChIKey | ZZCJGLUZCDJRRY-SMDDNHRTSA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 7 |
| Molecular weight (Da) | 504.1 |
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 |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| HCA2 | HCAR2 | Human | Hydroxycarboxylic acid | A | pIC50 | 8.22 | 8.22 | 8.22 | ChEMBL |
| HCA2 | HCAR2 | Human | Hydroxycarboxylic acid | A | pEC50 | 7.12 | 7.12 | 7.12 | ChEMBL |