CHEMBL3351044
SMILES | C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NN(C(=O)N(C)C(=O)c2ccccc2)[C@@H](O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)CSSC[C@@H](C(=O)O)NC(=O)[C@H](Cc2ccccc2)NC1=O |
InChIKey | SQPLVZLTUHGUDH-SMKJQIFISA-N |
Chemical properties
Hydrogen bond acceptors | 16 |
Hydrogen bond donors | 13 |
Rotatable bonds | 13 |
Molecular weight (Da) | 1152.5 |
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 |
SST4 | SSR4 | Human | Somatostatin | A | pIC50 | 8.27 | 8.27 | 8.27 | ChEMBL |
SST3 | SSR3 | Human | Somatostatin | A | pIC50 | 6.39 | 6.39 | 6.39 | ChEMBL |