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
 |
 |
 |
|
 |
|---|---|---|---|---|
| GQSYD | Dansylglycine |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd00226 |
| Smiles | |
| Inchi Key | InChIKey=JPQGHMJREVEPHD-YRXYAOOASA-N |
| Molecular weight | 1411.71 |
| Molecular formula | C76H101N9O15S |
| Chemical name | Peptide information |
| Sequence (one letter) | GQSYD |
| Length | 5 |
| Peptide name | pentapeptide |
| External ID | |
|---|---|
| CAS number | 1839533-26-4 |
| Other information | |
|---|---|
| Application | Synthesis, peptide-peptide ineraction inhibition |
| Additional function | Possible applications in cancers and neurolodegenerative diseases |
| Pharmacological class | other |
| Conjugate type | sulfonamide |
| Linker | no |
| Small molecule | Dansylglycine |
| Small molecule CAS | 1091-85-6 |
| Small molecule structure | |
| Calculated properties | |
|---|---|
| LogP | 8.78077 |
| Rotatable bonds | 37 |
| H bond donor | 8 |
| H bond acceptor | 14 |
| Polar surface area (PSA) | 316.33000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
Intracellular Generation of a Diterpene-Peptide Conjugate that Inhibits 14-3-3-Mediated Interactions | 2015 | Parvatkar, Prakash; Kato, Nobuo; Uesugi, Motonari; Sato, Shin-ichi; Ohkanda, Junko | Journal of the American Chemical Society | ||
