CHEMBL4467290
| SMILES | CCCCN(c1nc2ccccc2o1)[C@H](C)c1ccc(-c2ccccc2-c2nnn[nH]2)cc1 |
| InChIKey | XEHFWPJFUYLUSK-GOSISDBHSA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 8 |
| Molecular weight (Da) | 438.2 |
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 |
| chemerin | CML1 | Mouse | Chemerin receptor | A | pIC50 | 6.82 | 6.82 | 6.82 | ChEMBL |
| chemerin | CML1 | Human | Chemerin receptor | A | pIC50 | 6.96 | 6.96 | 6.96 | ChEMBL |
| chemerin | CML1 | Human | Chemerin receptor | A | pEC50 | 5.92 | 5.92 | 5.92 | ChEMBL |
| CXCR4 | CXCR4 | Human | Chemokine | A | pIC50 | 5.06 | 5.06 | 5.06 | ChEMBL |