CHEMBL1076622
| SMILES | Cc1nc2cc(C[C@H](C)CN3C[C@@H](C(=O)N4CCN(c5ccc(F)c(F)c5)CC4)[C@H]4CCCC[C@H]4C3)ccc2o1 |
| InChIKey | ORWKFKYYOVHTJR-FOEQRGQYSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 6 |
| Molecular weight (Da) | 550.3 |
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 | pKd | 5.86 | 5.86 | 5.86 | ChEMBL |
| SST4 | SSR4 | Human | Somatostatin | A | pKd | 6.38 | 6.38 | 6.38 | ChEMBL |
| SST5 | SSR5 | Human | Somatostatin | A | pKd | 5.96 | 5.96 | 5.96 | ChEMBL |
| SST3 | SSR3 | Human | Somatostatin | A | pKd | 8.47 | 8.47 | 8.47 | ChEMBL |
| SST2 | SSR2 | Human | Somatostatin | A | pKd | 5.26 | 5.26 | 5.26 | ChEMBL |
| SST2 | SSR2 | Rat | Somatostatin | A | pKd | 6.64 | 6.64 | 6.64 | ChEMBL |
| SST1 | SSR1 | Rat | Somatostatin | A | pKd | 6.34 | 6.34 | 6.34 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |