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
 |
 |
 |
|
 |
|---|---|---|---|---|
| PID | Vinblastine |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd01057 |
| Smiles | |
| Molecular weight | 1162.57 |
| Molecular formula | C62H80N7O15 |
| Chemical name | Peptide information |
| Sequence (one letter) | PID |
| Length | 3 |
| Peptide name | tripeptide |
| External ID | |
|---|---|
| CAS number | 1097833-59-4 |
| Other information | |
|---|---|
| Application | Anticancer, antimitotic |
| Pharmacological class | anticancer |
| Conjugate type | amide |
| Linker | no |
| Small molecule | Vinblastine |
| Small molecule CAS | 865-21-4 |
| Small molecule structure | |
| Structure method | 1H and 13C NMR, COSY |
| NMR solvent | CDCl3 |
| Calculated properties | |
|---|---|
| LogP | -3.32868 |
| Rotatable bonds | 21 |
| H bond donor | 6 |
| H bond acceptor | 14 |
| Polar surface area (PSA) | 283.74000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
Synthesis and Biological Evaluation of Vinca Alkaloids and Phomopsin Hybrids | 2009 | Ngo, Quoc Anh; Roussi, Fanny; Cormier, Anthony; Thoret, Sylviane; Knossow, Marcel; Guenard, Daniel; Gueritte, Francoise | Journal of Medicinal Chemistry | ||
