CHEMBL3659232
| SMILES | Cc1ccc(-c2ncccn2)c(C(=O)N2C3CCC2C(COc2ccc(F)cn2)C3)n1 |
| InChIKey | VLKKLBSEBRBZNR-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 419.2 |
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 | 7.75 | 7.75 | 7.75 | ChEMBL |
| OX1 | OX1R | Human | Orexin | A | pKi | 7.62 | 7.62 | 7.62 | ChEMBL |
| OX2 | OX2R | Human | Orexin | A | pKi | 7.09 | 7.09 | 7.09 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |