CHEMBL1823873
SMILES | C[C@H](N)C(=O)NCC(=O)N[C@H]1CSSC[C@@H](C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC1=O |
InChIKey | NHXLMOGPVYXJNR-ZPHDWPCDSA-N |
Chemical properties
Hydrogen bond acceptors | None |
Hydrogen bond donors | None |
Rotatable bonds | None |
Molecular weight (Da) |
Drug properties
Molecular type | Protein |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
SST1 | SSR1 | Human | Somatostatin | A | pKi | 9.49 | 9.49 | 9.49 | ChEMBL |
SST4 | SSR4 | Human | Somatostatin | A | pKi | 8.23 | 8.23 | 8.23 | ChEMBL |
SST5 | SSR5 | Human | Somatostatin | A | pKi | 9.34 | 9.34 | 9.34 | ChEMBL |
SST3 | SSR3 | Human | Somatostatin | A | pKi | 9.21 | 9.21 | 9.21 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
SST1 | SSR1 | Human | Somatostatin | A | pIC50 | 8.64 | 8.64 | 8.64 | ChEMBL |
SST4 | SSR4 | Human | Somatostatin | A | pIC50 | 8.64 | 8.64 | 8.64 | ChEMBL |
SST5 | SSR5 | Human | Somatostatin | A | pIC50 | 8.51 | 8.51 | 8.51 | ChEMBL |
SST2 | SSR2 | Human | Somatostatin | A | pIC50 | 8.96 | 8.96 | 8.96 | ChEMBL |
SST3 | SSR3 | Human | Somatostatin | A | pEC50 | 9.2 | 9.2 | 9.2 | ChEMBL |
SST3 | SSR3 | Human | Somatostatin | A | pIC50 | 8.62 | 8.62 | 8.62 | ChEMBL |