CHEMBL1207973
SMILES | CC(C)COc1ccc(Cl)cc1-c1ccccc1-c1cccc(C(=O)O)n1 |
InChIKey | RVMVCPKCWWFOEL-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 6 |
Molecular weight (Da) | 381.1 |
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 |
EP3 | PE2R3 | Human | Prostanoid | A | pKi | 5.7 | 5.7 | 5.7 | ChEMBL |
EP1 | PE2R1 | Human | Prostanoid | A | pKi | 8.6 | 8.6 | 8.6 | ChEMBL |
TP | TA2R | Human | Prostanoid | A | pKi | 6.5 | 6.5 | 6.5 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
EP1 | PE2R1 | Human | Prostanoid | A | pIC50 | 7.8 | 7.8 | 7.8 | ChEMBL |
TP | TA2R | Human | Prostanoid | A | pIC50 | 5.8 | 5.8 | 5.8 | ChEMBL |
EP1 | PE2R1 | Rat | Prostanoid | A | pIC50 | 7.9 | 7.9 | 7.9 | ChEMBL |