CHEMBL565992
SMILES | O=C(COc1cccc2ncn(Cc3ccc(Cl)cc3Cl)c12)NS(=O)(=O)c1cc(Cl)c(Cl)s1 |
InChIKey | GQXGWLGUUVXOJO-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 1 |
Rotatable bonds | 7 |
Molecular weight (Da) | 562.9 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
EP3 | PE2R3 | Mouse | Prostanoid | A | pIC50 | 8.4 | 8.4 | 8.4 | ChEMBL |
IP | PI2R | Human | Prostanoid | A | pIC50 | 5.23 | 5.23 | 5.23 | ChEMBL |
EP1 | PE2R1 | Human | Prostanoid | A | pIC50 | 5.1 | 5.1 | 5.1 | ChEMBL |
EP2 | PE2R2 | Human | Prostanoid | A | pIC50 | 5.32 | 5.32 | 5.32 | ChEMBL |
EP3 | PE2R3 | Human | Prostanoid | A | pIC50 | 7.1 | 8.34 | 8.96 | ChEMBL |
EP4 | PE2R4 | Human | Prostanoid | A | pIC50 | 4.99 | 4.99 | 4.99 | ChEMBL |