CHEMBL3665719
| SMILES | COc1ccc([C@H](C)NC(=O)COc2cc(C)c3c(-c4ccoc4C)nn(C)c3n2)cc1 |
| InChIKey | DEGZXMGBKUNGPA-HNNXBMFYSA-N |
Chemical properties
| Hydrogen bond acceptors | 7 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 7 |
| Molecular weight (Da) | 434.2 |
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 | Human | Orexin | A | pKd | 7.16 | 7.16 | 7.16 | ChEMBL |
| OX2 | OX2R | Human | Orexin | A | pKd | 6.73 | 6.73 | 6.73 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |