CHEMBL1806523
| SMILES | O=C([C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C(=O)Nc2ccccc2)C1)N1CCCC1 |
| InChIKey | MSOSXJRGMKTMRH-WZONZLPQSA-N |
Chemical properties
| Hydrogen bond acceptors | 2 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 2 |
| Molecular weight (Da) | 426.2 |
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 |
| CXCR3 | CXCR3 | Rat | Chemokine | A | pIC50 | 5.48 | 6.6 | 7.72 | ChEMBL |
| CXCR3 | CXCR3 | Human | Chemokine | A | pIC50 | 6.16 | 7.62 | 8.4 | ChEMBL |
| CXCR3 | CXCR3 | Mouse | Chemokine | A | pIC50 | 8.4 | 8.4 | 8.4 | ChEMBL |