CHEMBL3659230
| SMILES | Cc1cccc(OCC2CC3CCC2N3C(=O)c2nc(C)ccc2-n2nccn2)n1 |
| InChIKey | SWVFEAKNBGZQOW-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 7 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 404.2 |
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 |
| OX1 | OX1R | Rat | Orexin | A | pKi | 7.13 | 7.13 | 7.13 | ChEMBL |
| OX1 | OX1R | Human | Orexin | A | pKi | 7.34 | 7.34 | 7.34 | ChEMBL |
| OX2 | OX2R | Human | Orexin | A | pKi | 6.73 | 6.73 | 6.73 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |