CHEMBL78563
SMILES | CNc1ccc(C)cc1S(=O)(=O)Nc1onc(C)c1Br |
InChIKey | KPISXONXINCUAB-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 2 |
Rotatable bonds | 4 |
Molecular weight (Da) | 359.0 |
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 |
ETA | EDNRA | Human | Endothelin | A | pIC50 | 8.09 | 8.09 | 8.09 | ChEMBL |
ETB | EDNRB | Human | Endothelin | A | pIC50 | 6.03 | 6.03 | 6.03 | ChEMBL |