CHEMBL417651
SMILES | Cc1noc(NS(=O)(=O)c2cccc(-c3ccccc3)c2)c1C |
InChIKey | PFKPCLJGCDINDK-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 328.1 |
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 | Rat | Endothelin | A | pIC50 | 5.27 | 5.27 | 5.27 | ChEMBL |
ETA | EDNRA | Human | Endothelin | A | pIC50 | 6.24 | 6.24 | 6.24 | ChEMBL |
ETB | EDNRB | Human | Endothelin | A | pIC50 | 5.31 | 5.31 | 5.31 | ChEMBL |