CHEMBL93351
SMILES | NCCCC1CCCN2C(=O)[C@@H](Cc3c[nH]c4ccccc34)SCCN(Cc3cccc4ccccc34)C(=O)C12 |
InChIKey | DPGNBBMMTWINDM-NDORLILTSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 7 |
Molecular weight (Da) | 554.3 |
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 | 6.39 | 6.39 | 6.39 | ChEMBL |
SST4 | SSR4 | Human | Somatostatin | A | pIC50 | 7.39 | 7.39 | 7.39 | ChEMBL |
SST5 | SSR5 | Human | Somatostatin | A | pIC50 | 7.39 | 7.39 | 7.39 | ChEMBL |
SST2 | SSR2 | Human | Somatostatin | A | pIC50 | 6.56 | 6.56 | 6.56 | ChEMBL |
SST3 | SSR3 | Human | Somatostatin | A | pIC50 | 5.9 | 5.9 | 5.9 | ChEMBL |