CHEMBL3667563
| SMILES | O=C(Nc1ccccc1)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)s1 |
| InChIKey | PSYHWFIOJGJPSO-LBPRGKRZSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 4 |
| Molecular weight (Da) | 414.0 |
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 |
| OX1 | OX1R | Human | Orexin | A | pIC50 | 6.48 | 6.48 | 6.48 | ChEMBL |
| OX2 | OX2R | Human | Orexin | A | pIC50 | 6.79 | 6.79 | 6.79 | ChEMBL |