CHEMBL223151
| SMILES | CCCCC[C@H](O)/C=C/[C@H]1CCC(=O)N1CCSCCCC(=O)O |
| InChIKey | LDTVAEAOOFGOEC-OZVGAOPWSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 13 |
| Molecular weight (Da) | 357.2 |
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 | 5.6 | 5.6 | 5.6 | ChEMBL |
| EP4 | PE2R4 | Human | Prostanoid | A | pKi | 8.42 | 8.42 | 8.42 | ChEMBL |
| EP2 | PE2R2 | Human | Prostanoid | A | pKi | 5.33 | 5.33 | 5.33 | ChEMBL |
| EP3 | PE2R3 | Human | Prostanoid | A | pKi | 5.72 | 5.72 | 5.72 | ChEMBL |
| EP3 | PE2R3 | Mouse | Prostanoid | A | pKi | 7.58 | 7.58 | 7.58 | ChEMBL |
| EP4 | PE2R4 | Mouse | Prostanoid | A | pKi | 8.7 | 8.7 | 8.7 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| EP4 | PE2R4 | Rat | Prostanoid | A | pEC50 | 8.7 | 8.7 | 8.7 | ChEMBL |
| EP4 | PE2R4 | Human | Prostanoid | A | pEC50 | 7.77 | 7.77 | 7.77 | ChEMBL |