CHEMBL3782037
| SMILES | CCn1cc(C[C@H](NC(=O)[C@@H]2CCC(=O)N2)C(=O)N2CCC[C@H]2C(N)=O)nc1I |
| InChIKey | FEYNLKPAUFBURK-AVGNSLFASA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 7 |
| Molecular weight (Da) | 516.1 |
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 |
| TRH1 | TRHR | Mouse | Thyrotropin-releasing hormone | A | pIC50 | 5.93 | 5.93 | 5.93 | ChEMBL |
| TRH1 | TRHR | Mouse | Thyrotropin-releasing hormone | A | pEC50 | 7.89 | 8.1 | 8.31 | ChEMBL |