CHEMBL5431224
| SMILES | O=C(O)c1ccc(CNC(=O)c2c3ccccc3nn2Cc2ccc(C(F)(F)F)cc2)cc1 |
| InChIKey | MLXNRQYLAVQFEJ-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 6 |
| Molecular weight (Da) | 453.1 |
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 |
| EP4 | PE2R4 | Human | Prostanoid | A | pKd | 9.06 | 9.06 | 9.06 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| EP4 | PE2R4 | Rat | Prostanoid | A | pIC50 | 7.44 | 7.44 | 7.44 | ChEMBL |
| EP4 | PE2R4 | Mouse | Prostanoid | A | pIC50 | 8.8 | 8.8 | 8.8 | ChEMBL |
| EP4 | PE2R4 | Human | Prostanoid | A | pIC50 | 8.39 | 8.77 | 9.05 | ChEMBL |