CHEMBL3902700
SMILES | O=C(O)c1ccc(CC[C@H]2C(=O)CC[C@@H]2/C=C/C(O)Cc2cccc(Cl)c2)cc1 |
InChIKey | YQAHEMJLXLEJPE-FSKZSRKQSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 8 |
Molecular weight (Da) | 412.1 |
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 |
EP2 | PE2R2 | Human | Prostanoid | A | pKi | 5.56 | 5.56 | 5.56 | ChEMBL |
EP4 | PE2R4 | Human | Prostanoid | A | pKi | 8.7 | 8.7 | 8.7 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
EP2 | PE2R2 | Human | Prostanoid | A | pEC50 | 6.91 | 6.91 | 6.91 | ChEMBL |
EP4 | PE2R4 | Human | Prostanoid | A | pEC50 | 8.7 | 8.7 | 8.7 | ChEMBL |
TP | TA2R | Human | Prostanoid | A | pEC50 | 5.32 | 5.32 | 5.32 | ChEMBL |