CHEMBL1643801
SMILES | CN([C@@H]1CCc2c(CC(=O)O)c3ccccc3n2C1)S(=O)(=O)c1ccc(Cl)s1 |
InChIKey | UVDYNJXUCJCCQN-GFCCVEGCSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 438.0 |
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 |
DP1 | PD2R | Human | Prostanoid | A | pKi | 6.55 | 6.55 | 6.55 | ChEMBL |
DP2 | PD2R2 | Human | Prostanoid | A | pKi | 8.2 | 8.2 | 8.2 | ChEMBL |
TP | TA2R | Human | Prostanoid | A | pKi | 5.55 | 5.55 | 5.55 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
DP2 | PD2R2 | Human | Prostanoid | A | pIC50 | 7.89 | 7.89 | 7.89 | ChEMBL |