CHEMBL332446
SMILES | CC(CC(=O)O)c1ccccc1-c1csc(-c2ccccc2OCc2ccccc2)c1 |
InChIKey | XBHVHPVSZSYEAH-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 8 |
Molecular weight (Da) | 428.1 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Sankey plot
Compound is not listed as a drug.
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
EP1 | PE2R1 | Human | Prostanoid | A | pKi | 4.46 | 4.46 | 4.46 | ChEMBL |
EP2 | PE2R2 | Human | Prostanoid | A | pKi | 5.34 | 5.34 | 5.34 | ChEMBL |
EP3 | PE2R3 | Human | Prostanoid | A | pKi | 7.46 | 7.46 | 7.46 | ChEMBL |
EP4 | PE2R4 | Human | Prostanoid | A | pKi | 5.96 | 5.96 | 5.96 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |