AZ3451
| SMILES | N#Cc1ccc(cc1)NC(=O)c1ccc2c(c1)nc(n2[C@H](C1CCCCC1)C)c1cc2OCOc2cc1Br |
| InChIKey | FJAOGFGHTPYADT-SFHVURJKSA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 570.1 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Database connections
| Structure pdb | 5NDZ |
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| PAR2 | PAR2 | Human | Proteinase-activated | A | pKd | 7.87 | 7.87 | 7.87 | Guide to Pharmacology |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| PAR2 | PAR2 | Human | Proteinase-activated | A | pIC50 | 7.955 | 7.96 | 7.96 | Guide to Pharmacology |
| PAR4 | PAR4 | Human | Proteinase-activated | A | pIC50 | 6.42 | 6.42 | 6.42 | ChEMBL |
| PAR2 | PAR2 | Human | Proteinase-activated | A | pIC50 | 5.18 | 5.18 | 5.18 | ChEMBL |