CHEMBL29311
SMILES | NCCCCCOC[C@@H]1O[C@H](OCCc2c[nH]c3ccccc23)[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1 |
InChIKey | XESWSTANEUBVSE-VMHWWVBCSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 2 |
Rotatable bonds | 20 |
Molecular weight (Da) | 678.4 |
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 |
SST1 | SSR1 | Human | Somatostatin | A | pKi | 5.4 | 5.4 | 5.4 | ChEMBL |
SST4 | SSR4 | Human | Somatostatin | A | pKi | 5.72 | 5.72 | 5.72 | ChEMBL |
SST5 | SSR5 | Human | Somatostatin | A | pKi | 5.41 | 5.41 | 5.41 | ChEMBL |
SST2 | SSR2 | Human | Somatostatin | A | pKi | 5.58 | 5.58 | 5.58 | ChEMBL |
SST3 | SSR3 | Human | Somatostatin | A | pKi | 5.48 | 5.48 | 5.48 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |