CHEMBL293647
SMILES | Cc1cc(C[C@H](O)/C=C/[C@H]2[C@H](O)CC(=O)[C@@H]2CCSCCCC(=O)O)ccc1O |
InChIKey | KZNUTTVPLNHFID-ZVAONMGWSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 4 |
Rotatable bonds | 11 |
Molecular weight (Da) | 422.2 |
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 |
EP2 | PE2R2 | Mouse | Prostanoid | A | pKi | 5.13 | 5.13 | 5.13 | ChEMBL |
EP4 | PE2R4 | Mouse | Prostanoid | A | pKi | 8.31 | 8.31 | 8.31 | ChEMBL |
EP3 | PE2R3 | Mouse | Prostanoid | A | pKi | 5.54 | 5.54 | 5.54 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
EP4 | PE2R4 | Mouse | Prostanoid | A | pEC50 | 7.7 | 7.7 | 7.7 | ChEMBL |