16,16-dimethyl-PGE2
| SMILES | CCCCC([C@@H](/C=C/[C@H]1[C@H](O)CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O)(C)C |
| InChIKey | QAOBBBBDJSWHMU-WMBBNPMCSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 12 |
| Molecular weight (Da) | 380.3 |
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 |
| EP3 | PE2R3 | Mouse | Prostanoid | A | pKi | 8.72 | 8.72 | 8.72 | Guide to Pharmacology |
| EP2 | PE2R2 | Mouse | Prostanoid | A | pKi | 7.8 | 7.8 | 7.8 | Guide to Pharmacology |
| EP4 | PE2R4 | Mouse | Prostanoid | A | pKi | 7.4 | 7.4 | 7.4 | Guide to Pharmacology |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |