L-803,087
| SMILES | COC(=O)[C@@H](NC(=O)CCCc1c([nH]c2c1cc(F)cc2F)c1ccccc1)CCCN=C(N)N |
| InChIKey | OPNMQSFIGUSHDH-FQEVSTJZSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 4 |
| Rotatable bonds | 11 |
| Molecular weight (Da) | 485.2 |
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 |
| SST2 | SSR2 | Human | Somatostatin | A | pKi | 5.33 | 5.33 | 5.33 | ChEMBL |
| SST4 | SSR4 | Human | Somatostatin | A | pKi | 9.15 | 9.15 | 9.15 | ChEMBL |
| SST4 | SSR4 | Human | Somatostatin | A | pKi | 9.2 | 9.2 | 9.2 | Guide to Pharmacology |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| SST4 | SSR4 | Human | Somatostatin | A | pIC50 | 8.38 | 8.38 | 8.38 | ChEMBL |