CHEMBL3930758
| SMILES | COc1ccc2c(c1C1CCCC(=O)N1Cc1csc(-c3ccccc3)n1)OCO2 |
| InChIKey | JCLMFWJPHWKWTL-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 422.1 |
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 | 6.97 | 6.97 | 6.97 | ChEMBL |
| OX2 | OX2R | Human | Orexin | A | pIC50 | 7.4 | 7.4 | 7.4 | ChEMBL |