Use the buttons at the bottom of Jsmol viewer to see different representations, ON/OFF Hydrogens, and ON/OFF rotation.
3D model is for representation purpose only.
.
.
Schematic representation of peptide, linker and drug in the peptide-drug conjugates
 |
 |
 |
|
 |
|---|---|---|---|---|
| EE | Naproxen |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd00991 |
| Smiles | |
| Molecular weight | 935.363 |
| Molecular formula | C54H53N3O12 |
| Chemical name | Peptide information |
| Sequence (one letter) | EE |
| Length | 2 |
| Peptide name | dipeptide |
| External ID | |
|---|---|
| CAS number | 1186099-23-9 |
| Other information | |
|---|---|
| Application | bone-targeting (prodrug) |
| Additional function | Inreased water solubility |
| Pharmacological class | Anti-inflammatory |
| Conjugate type | amide |
| Linker | no |
| Small molecule | Naproxen |
| Small molecule CAS | 22204-53-1 |
| Small molecule structure | |
| Structure method | 1H NMR, MS |
| NMR solvent | CDCl3 or D2O |
| Calculated properties | |
|---|---|
| LogP | 6.93226 |
| Rotatable bonds | 27 |
| H bond donor | 3 |
| H bond acceptor | 8 |
| Polar surface area (PSA) | 201.73000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
Synthesis and preliminary evaluation in vitro of novel naproxen-dendritic peptide conjugates | 2009 | Ouyang, Liang; Zhang, Jing; Pan, Junzhu; Yan, Linna; Guo, Li | Drug Delivery | ||
