CHEMBL29102
SMILES | CO[C@@H]1O[C@H](COCCCCCN)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1 |
InChIKey | AFZZYNSWDWCNIN-IZDBAANZSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 1 |
Rotatable bonds | 17 |
Molecular weight (Da) | 549.3 |
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 |
SST1 | SSR1 | Human | Somatostatin | A | pKi | 5.62 | 5.62 | 5.62 | ChEMBL |
SST4 | SSR4 | Human | Somatostatin | A | pKi | 5.7 | 5.7 | 5.7 | ChEMBL |
SST5 | SSR5 | Human | Somatostatin | A | pKi | 5.52 | 5.52 | 5.52 | ChEMBL |
SST2 | SSR2 | Human | Somatostatin | A | pKi | 5.34 | 5.34 | 5.34 | ChEMBL |
SST3 | SSR3 | Human | Somatostatin | A | pKi | 5.52 | 5.52 | 5.52 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |