CHEMBL1096382
| SMILES | Cc1cccc(Nc2ccc(CCC(=O)O)c(C(=O)N[C@H](CC(C)C)c3cc(C)cc(C)c3)c2)c1 |
| InChIKey | ZZJHRDCBOAXDCW-MUUNZHRXSA-N |
Chemical properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 10 |
| Molecular weight (Da) | 472.3 |
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 |
| EP2 | PE2R2 | Mouse | Prostanoid | A | pKi | 5.28 | 5.28 | 5.28 | ChEMBL |
| EP4 | PE2R4 | Mouse | Prostanoid | A | pKi | 6.75 | 6.75 | 6.75 | ChEMBL |
| EP3 | PE2R3 | Mouse | Prostanoid | A | pKi | 9.41 | 9.41 | 9.41 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| EP3 | PE2R3 | Mouse | Prostanoid | A | pIC50 | 8.26 | 8.26 | 8.26 | ChEMBL |