CHEMBL436783
SMILES | C[C@@H](O)[C@H](NC(=O)[C@@H]1CSC[C@@H](NC(=O)[C@H](N)Cc2ccccc2)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@H](CCCCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N1)C(N)=O |
InChIKey | DTIUHIDPXKIHMG-MNTGUQQXSA-N |
Chemical properties
Hydrogen bond acceptors | 13 |
Hydrogen bond donors | 13 |
Rotatable bonds | 17 |
Molecular weight (Da) | 999.5 |
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 |
SST2 | SSR2 | Mouse | Somatostatin | A | pIC50 | 7.78 | 7.79 | 7.81 | ChEMBL |
SST5 | SSR5 | Human | Somatostatin | A | pIC50 | 8.31 | 8.31 | 8.31 | ChEMBL |