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
 |
 |
 |
|
 |
|---|---|---|---|---|
| VGGVVIA | Trolox |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd00189 |
| Smiles | |
| Inchi Key | InChIKey=WOGRTDZOPNURTM-LCEXRRSYSA-N |
| Molecular weight | 845.49 |
| Molecular formula | C42H67N7O11 |
| Chemical name | Peptide information |
| Sequence (one letter) | VGGVVIA |
| Length | 7 |
| Peptide name | amyloid-beta C-terminal motif |
| External ID | |
|---|---|
| CAS number | 1972631-85-8 |
| Other information | |
|---|---|
| Application | Alzheimer’s disease therapy, anti-aggregation and antioxidant |
| Pharmacological class | neurological |
| Conjugate type | amide |
| Linker | no |
| Small molecule | Trolox |
| Small molecule CAS | 53188-07-01 |
| Calculated properties | |
|---|---|
| LogP | 2.76082 |
| Rotatable bonds | 20 |
| H bond donor | 9 |
| H bond acceptor | 11 |
| Polar surface area (PSA) | 270.46000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
Design, synthesis, and evaluation of Trolox-conjugated amyloid-β C-terminal peptides for therapeutic intervention in an in vitro model of Alzheimer’s disease | 2016 | Arai, Takuya; Ohno, Akiko; Kazunori, Mori; Kakizawa, Taeko; Kuwata, Hiroshi; Ozawa, Toshihiko; Shibanuma, Motoko; Hara, Shuntaro; Ishida, Seiichi; Kurihara, Masaaki; Miyata, Naoki; Nakagawa, Hidehiko; Fukuhara, Kiyoshi | Bioorganic & Medicinal Chemistry | ||
