CHEMBL87366
SMILES | O=C(CCc1ccccc1-c1ccc(OCCCOc2cccc(CSCCc3ccccc3)c2)cc1)NS(=O)(=O)c1cccs1 |
InChIKey | NNDRPNPOLHKHSD-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 1 |
Rotatable bonds | 17 |
Molecular weight (Da) | 671.2 |
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 | 4.89 | 4.89 | 4.89 | ChEMBL |
EP2 | PE2R2 | Human | Prostanoid | A | pKi | 5.31 | 5.31 | 5.31 | ChEMBL |
EP3 | PE2R3 | Human | Prostanoid | A | pKi | 7.8 | 7.8 | 7.8 | ChEMBL |
EP4 | PE2R4 | Human | Prostanoid | A | pKi | 5.15 | 5.15 | 5.15 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |