CHEMBL4099851
SMILES | C[C@H](NC(=O)c1cc(Cl)cnc1Oc1cccc(F)c1)c1ccc(C(=O)O)cc1 |
InChIKey | FKXDPPYCCKCVCW-LBPRGKRZSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 6 |
Molecular weight (Da) | 414.1 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
EP4 | Q9TU16 | Dog | Prostanoid | A | pKi | 7.42 | 7.42 | 7.42 | ChEMBL |
EP4 | PE2R4 | Rat | Prostanoid | A | pKi | 8.21 | 8.21 | 8.21 | ChEMBL |
EP4 | PE2R4 | Rat | Prostanoid | A | pKd | 8.34 | 8.34 | 8.34 | ChEMBL |
EP4 | PE2R4 | Mouse | Prostanoid | A | pKd | 9.0 | 9.0 | 9.0 | ChEMBL |
EP2 | PE2R2 | Human | Prostanoid | A | pKi | 5.74 | 5.74 | 5.74 | ChEMBL |
EP4 | PE2R4 | Human | Prostanoid | A | pKd | 8.97 | 8.97 | 8.97 | ChEMBL |
EP4 | PE2R4 | Human | Prostanoid | A | pKi | 9.01 | 9.01 | 9.01 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
EP2 | PE2R2 | Human | Prostanoid | A | pIC50 | 5.72 | 5.72 | 5.72 | ChEMBL |
EP4 | PE2R4 | Human | Prostanoid | A | pIC50 | 7.79 | 8.21 | 8.62 | ChEMBL |