CHEMBL430381
| SMILES | OCC(CO)Nc1nc(SCc2cccc(F)c2F)nc2nc(NC3CC3)sc12 |
| InChIKey | PAUMNFOGCBXNRU-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 9 |
| Hydrogen bond donors | 4 |
| Rotatable bonds | 9 |
| Molecular weight (Da) | 439.1 |
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 |
| CXCR2 | CXCR2 | Human | Chemokine | A | pIC50 | 7.0 | 7.0 | 7.0 | ChEMBL |