CHEMBL4212770
SMILES | C[C@@](O)(C/C=C/[C@H]1CCC(=O)[C@@H]1CCSc1nc(C(=O)O)cs1)CCC(F)(F)F |
InChIKey | WQXORXCPXXDTAR-CMPKWODGSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 2 |
Rotatable bonds | 10 |
Molecular weight (Da) | 451.1 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
EP2 | PE2R2 | Human | Prostanoid | A | pEC50 | 9.43 | 9.43 | 9.43 | ChEMBL |
EP3 | PE2R3 | Human | Prostanoid | A | pEC50 | 8.46 | 8.46 | 8.46 | ChEMBL |
EP4 | PE2R4 | Human | Prostanoid | A | pEC50 | 6.9 | 6.9 | 6.9 | ChEMBL |