CHEMBL218280
SMILES | COc1cc(/C=C/Cc2ccccc2/C=C/C(=O)NS(=O)(=O)c2cccs2)ccc1OCc1ccccc1 |
InChIKey | LLYRAKUTPUBVDD-REFRTJCBSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 11 |
Molecular weight (Da) | 545.1 |
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 | 5.82 | 5.82 | 5.82 | ChEMBL |
EP2 | PE2R2 | Human | Prostanoid | A | pKi | 5.06 | 5.06 | 5.06 | ChEMBL |
EP3 | PE2R3 | Human | Prostanoid | A | pKi | 8.8 | 8.8 | 8.8 | ChEMBL |
EP4 | PE2R4 | Human | Prostanoid | A | pKi | 6.08 | 6.08 | 6.08 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |