CHEMBL1187458
| SMILES | CS(=O)(=O)N1CC2(CCN(C(=O)N[C@@H]3Cc4c([nH]c5ccccc45)CN([C@@H](CCCCN)C(=O)NCc4ccccc4)C3=O)CC2)c2ccccc21 |
| InChIKey | ZRLQSDWBAMIIJJ-LDNVYYCDSA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 4 |
| Rotatable bonds | 10 |
| Molecular weight (Da) | 725.3 |
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 |
| SST1 | SSR1 | Human | Somatostatin | A | pIC50 | 6.08 | 6.08 | 6.08 | ChEMBL |
| SST4 | SSR4 | Human | Somatostatin | A | pIC50 | 8.68 | 8.68 | 8.68 | ChEMBL |
| SST2 | SSR2 | Human | Somatostatin | A | pIC50 | 6.49 | 6.49 | 6.49 | ChEMBL |
| SST3 | SSR3 | Human | Somatostatin | A | pIC50 | 6.5 | 6.5 | 6.5 | ChEMBL |
| SST5 | SSR5 | Human | Somatostatin | A | pIC50 | 8.1 | 8.1 | 8.1 | ChEMBL |