CHEMBL3955128
SMILES | CCCCC[C@H](O)/C=C/[C@H]1CC(F)(F)C(=O)N1CCCCCCC(=O)O |
InChIKey | PWZMQIUUWBQDQW-WFPWZJHXSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 13 |
Molecular weight (Da) | 375.2 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
EP2 | PE2R2 | Human | Prostanoid | A | pKi | 6.48 | 6.48 | 6.48 | ChEMBL |
EP4 | PE2R4 | Human | Prostanoid | A | pKi | 9.68 | 9.69 | 9.7 | ChEMBL |
EP3 | PE2R3 | Human | Prostanoid | A | pKi | 6.46 | 6.46 | 6.46 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
EP2 | PE2R2 | Human | Prostanoid | A | pEC50 | 5.64 | 6.17 | 6.69 | ChEMBL |
EP4 | PE2R4 | Human | Prostanoid | A | pIC50 | 9.24 | 9.24 | 9.24 | ChEMBL |
EP4 | PE2R4 | Human | Prostanoid | A | pEC50 | 9.43 | 9.95 | 10.68 | ChEMBL |