CHEMBL96554
SMILES | CCCCc1nn(-c2ccccc2C(F)(F)F)c(=O)n1Cc1ccc(-c2cc(CCC)ccc2S(=O)(=O)NC(=O)OC(C)(C)C)cc1 |
InChIKey | IKSMFLPUCVAYHQ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 8 |
Hydrogen bond donors | 1 |
Rotatable bonds | 11 |
Molecular weight (Da) | 672.3 |
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 |
AT1 | AGTR1 | Rabbit | Angiotensin | A | pIC50 | 8.0 | 8.0 | 8.0 | ChEMBL |
AT2 | AGTR2 | Human | Angiotensin | A | pIC50 | 6.57 | 6.57 | 6.57 | ChEMBL |
AT1 | AGTR1 | Human | Angiotensin | A | pIC50 | 6.82 | 6.82 | 6.82 | ChEMBL |
AT2 | AGTR2 | Rat | Angiotensin | A | pIC50 | 8.09 | 8.09 | 8.09 | ChEMBL |