CHEMBL439350
SMILES | CC(C)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](C)NC(=O)[C@H](NN2Cc3ccccc3CC2C(=O)O)CSSC[C@@H](C(=O)NN2Cc3ccccc3CC2C(=O)O)NC1=O |
InChIKey | WZXPLNACSQIOBU-DEYQLAJGSA-N |
Chemical properties
Hydrogen bond acceptors | 14 |
Hydrogen bond donors | 11 |
Rotatable bonds | 13 |
Molecular weight (Da) | 1055.4 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Sankey plot
Compound is not listed as a drug.
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
SST1 | SSR1 | Human | Somatostatin | A | pKi | 5.99 | 5.99 | 5.99 | ChEMBL |
SST2 | SSR2 | Human | Somatostatin | A | pKi | 6.46 | 6.46 | 6.46 | ChEMBL |
SST3 | SSR3 | Human | Somatostatin | A | pKi | 6.1 | 6.1 | 6.1 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |