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
 |
 |
 |
|
 |
|---|---|---|---|---|
| SSFY | Cyclophosphamide |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd01031 |
| Smiles | |
| Molecular weight | 893.268 |
| Molecular formula | C39H50Cl2N7O11P |
| Chemical name | Peptide information |
| Sequence (one letter) | SSFY |
| Length | 4 |
| Peptide name | tetrapeptide |
| External ID | |
|---|---|
| CAS number | 1161754-72-8 |
| Other information | |
|---|---|
| Application | Anticancer therapy, prostate cancer |
| Additional function | targeting prostate cancer (prodrug) |
| Pharmacological class | anticancer |
| Conjugate type | amide |
| Linker | no |
| Small molecule | Cyclophosphamide |
| Small molecule CAS | 50-18-0 |
| Small molecule structure | |
| Structure method | 1H and 31P NMR |
| Calculated properties | |
|---|---|
| LogP | 0.76759 |
| Rotatable bonds | 23 |
| H bond donor | 9 |
| H bond acceptor | 9 |
| Polar surface area (PSA) | 256.99000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
Synthesis and stereochemical preference of peptide 4-aminocyclophosphamide conjugates as potential prodrugs of phosphoramide mustard for activation by prostate-specific antigen (PSA) | 2009 | Jiang, Yongying; Di Paola, Robert S.; Hu, Longqin | Bioorganic & Medicinal Chemistry | ||
