CHEMBL1813276
SMILES | Cc1c(CC(=O)O)c2cc(F)ccc2n1C(=O)c1ccc(OC[C@@H]2CN(C)c3ccccc3O2)cc1Cl |
InChIKey | ZTQFWIHDGMZBBP-IBGZPJMESA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 6 |
Molecular weight (Da) | 522.1 |
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 |
FP | PF2R | Mouse | Prostanoid | A | pKi | 5.92 | 5.92 | 5.92 | ChEMBL |
DP1 | PD2R | Mouse | Prostanoid | A | pKi | 8.28 | 8.28 | 8.28 | ChEMBL |
EP2 | PE2R2 | Mouse | Prostanoid | A | pKi | 6.43 | 6.43 | 6.43 | ChEMBL |
EP4 | PE2R4 | Mouse | Prostanoid | A | pKi | 5.39 | 5.39 | 5.39 | ChEMBL |
EP3 | PE2R3 | Mouse | Prostanoid | A | pKi | 5.5 | 5.5 | 5.5 | ChEMBL |
IP | PI2R | Human | Prostanoid | A | pKi | 6.7 | 6.7 | 6.7 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
DP1 | PD2R | Mouse | Prostanoid | A | pIC50 | 8.8 | 8.8 | 8.8 | ChEMBL |