CHEMBL1187458
SMILES | CS(=O)(=O)N1CC2(CCN(C(=O)N[C@@H]3Cc4c([nH]c5ccccc45)CN([C@@H](CCCCN)C(=O)NCc4ccccc4)C3=O)CC2)c2ccccc21 |
InChIKey | ZRLQSDWBAMIIJJ-LDNVYYCDSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 4 |
Rotatable bonds | 10 |
Molecular weight (Da) | 725.3 |
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 |
SST1 | SSR1 | Human | Somatostatin | A | pIC50 | 6.08 | 6.08 | 6.08 | ChEMBL |
SST4 | SSR4 | Human | Somatostatin | A | pIC50 | 8.68 | 8.68 | 8.68 | ChEMBL |
SST2 | SSR2 | Human | Somatostatin | A | pIC50 | 6.49 | 6.49 | 6.49 | ChEMBL |
SST3 | SSR3 | Human | Somatostatin | A | pIC50 | 6.5 | 6.5 | 6.5 | ChEMBL |
SST5 | SSR5 | Human | Somatostatin | A | pIC50 | 8.1 | 8.1 | 8.1 | ChEMBL |