CHEMBL1309871
| SMILES | O=C(NNC(=O)c1cc(-c2ccccc2)nn1-c1ccccc1)c1ccccc1 |
| InChIKey | BWSDYKXKOONUOR-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 4 |
| Molecular weight (Da) | 382.1 |
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 |
| apelin | APJ | Human | Apelin | A | pIC50 | 4.83 | 4.83 | 4.83 | ChEMBL |
| CCR6 | CCR6 | Human | Chemokine | A | pIC50 | 4.59 | 4.81 | 5.03 | ChEMBL |
| CXCR5 | CXCR5 | Human | Chemokine | A | pIC50 | 4.9 | 4.9 | 4.9 | ChEMBL |