CHEMBL3775284
SMILES | c1ccc2c3c([nH]c2c1)[C@@H](C1CCOCC1)N[C@@H](c1nc(-c2csc4ccccc24)c[nH]1)C3 |
InChIKey | PAQMBKGYCRJEDT-RCZVLFRGSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 3 |
Rotatable bonds | 3 |
Molecular weight (Da) | 454.2 |
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 |
SST3 | SSR3 | Human | Somatostatin | A | pEC50 | 7.96 | 7.96 | 7.96 | ChEMBL |
SST3 | SSR3 | Human | Somatostatin | A | pIC50 | 8.0 | 8.0 | 8.0 | ChEMBL |