CHEMBL507148
SMILES | C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](N(C)C(=O)c2ccccc2)NC(=O)[C@H](NC(=O)[C@H](N)Cc2ccc(Cl)cc2)CSSC[C@@H](C(=O)N[C@@H](Cc2ccc3ccccc3c2)C(N)=O)NC1=O |
InChIKey | FXNXFWJCFNNAGW-FRNCAALFSA-N |
Chemical properties
Hydrogen bond acceptors | 14 |
Hydrogen bond donors | 12 |
Rotatable bonds | 18 |
Molecular weight (Da) | 1204.4 |
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 |
SST5 | SSR5 | Human | Somatostatin | A | pIC50 | 6.36 | 6.36 | 6.36 | ChEMBL |
SST2 | SSR2 | Human | Somatostatin | A | pIC50 | 7.77 | 7.77 | 7.77 | ChEMBL |
SST3 | SSR3 | Human | Somatostatin | A | pIC50 | 6.08 | 6.08 | 6.08 | ChEMBL |