CHEMBL3582317
| SMILES | Cc1nc([C@]2(c3cnn(C)c3)N[C@@H](c3nc(-c4ccc(F)cn4)c[nH]3)Cc3c2[nH]c2ccccc32)no1 |
| InChIKey | MQOWSXSGMALBJL-QFQXNSOFSA-N |
Chemical properties
| Hydrogen bond acceptors | 8 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 4 |
| Molecular weight (Da) | 495.2 |
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 |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| SST1 | SSR1 | Human | Somatostatin | A | pIC50 | 5.64 | 5.64 | 5.64 | ChEMBL |
| SST4 | SSR4 | Human | Somatostatin | A | pIC50 | 5.5 | 5.5 | 5.5 | ChEMBL |
| SST3 | SSR3 | Human | Somatostatin | A | pIC50 | 8.44 | 8.52 | 8.6 | ChEMBL |
| SST3 | SSR3 | Human | Somatostatin | A | pEC50 | 8.6 | 8.6 | 8.6 | ChEMBL |
| SST5 | SSR5 | Human | Somatostatin | A | pIC50 | 5.0 | 5.0 | 5.0 | ChEMBL |