CHEMBL292493
| SMILES | CCCC1C[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(N)=O)N(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)CN)C1 |
| InChIKey | OGWBASUUCLOVLN-ZKGQYAQGSA-N |
Chemical properties
| Hydrogen bond acceptors | 7 |
| Hydrogen bond donors | 7 |
| Rotatable bonds | 16 |
| Molecular weight (Da) | 661.3 |
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 |
| CCK2 | GASR | Human | Cholecystokinin | A | pIC50 | 8.72 | 8.72 | 8.72 | ChEMBL |
| CCK1 | CCKAR | Human | Cholecystokinin | A | pIC50 | 5.57 | 5.57 | 5.57 | ChEMBL |