CHEMBL335223
| SMILES | CC(C)C(=O)N1CCC(C(=O)NC(C(=O)N[C@@H](CCCCN)C(=O)OC(C)(C)C)[C@@H](C)c2c[nH]c3ccccc23)CC1 |
| InChIKey | VZSXZFYCTCSIIL-HNJDVHBFSA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 4 |
| Rotatable bonds | 12 |
| Molecular weight (Da) | 583.4 |
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 |
| SST5 | SSR5 | Human | Somatostatin | A | pKi | 5.54 | 5.54 | 5.54 | ChEMBL |
| SST3 | SSR3 | Human | Somatostatin | A | pKi | 5.28 | 5.28 | 5.28 | ChEMBL |
| SST2 | SSR2 | Human | Somatostatin | A | pKi | 7.82 | 7.82 | 7.82 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |