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
 |
 |
 |
|
 |
|---|---|---|---|---|
| KKK | succinic acid | Porphyrin derivative |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd01313 |
| Smiles | |
| Molecular weight | 1126.59 |
| Molecular formula | C67H74N12O5 |
| Chemical name | Peptide information |
| Sequence (one letter) | KKK |
| Length | 3 |
| Peptide name | tripeptide |
| External ID | |
|---|---|
| CAS number | 863708-69-4 |
| Other information | |
|---|---|
| Application | Anticancer therapy, photosensitizer |
| Additional function | Improving water solubility |
| Pharmacological class | anticancer |
| Conjugate type | amide |
| Linker | N/A |
| Linker Type | succinic acid |
| Small molecule | Porphyrin derivative |
| Small molecule CAS | 67605-64-5 |
| Structure method | 1H and 13C NMR, HPLC |
| NMR solvent | CDCl3 |
| Calculated properties | |
|---|---|
| LogP | 7.91592 |
| Rotatable bonds | 27 |
| H bond donor | 10 |
| H bond acceptor | 10 |
| Polar surface area (PSA) | 294.91000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
Synthesis and characterization of positively charged porphyrin-peptide conjugates | 2005 | Sibrian-Vazquez, Martha; Jensen, Timothy J.; Fronczek, Frank R.; Hammer, Robert P.; Vicente, M. Graca H. | Bioconjugate Chemistry | ||
