CHEMBL417358
| SMILES | Cc1noc(NS(=O)(=O)c2ccsc2C(=O)NCc2ccccc2)c1Br |
| InChIKey | YERLCYSKOWRFNL-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 6 |
| Molecular weight (Da) | 455.0 |
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 |
| ETB | EDNRB | Human | Endothelin | A | pIC50 | 4.01 | 4.01 | 4.01 | ChEMBL |
| ETA | EDNRA | Human | Endothelin | A | pIC50 | 6.64 | 6.64 | 6.64 | ChEMBL |