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
 |
 |
 |
|
 |
|---|---|---|---|---|
| KVAR | Caffeic acid |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd00632 |
| Smiles | |
| Inchi Key | InChIKey=WAPLFBCKONYFPZ-CDSYHYPYSA-N |
| Molecular weight | 633.36 |
| Molecular formula | C29H47N9O7 |
| Chemical name | Peptide information |
| Sequence (one letter) | KVAR |
| Length | 4 |
| Peptide name | melanocortin receptor 1 (MC1R) antagonist peptide |
| External ID | |
|---|---|
| CAS number | 1433981-72-6 |
| Other information | |
|---|---|
| Application | Synthesis, melanogenesis inhibition (melanocortin receptor 1 (MC1R) anatonists) |
| Additional function | Possible treatment for hyperpigmentation, |
| Conjugate type | amide |
| Linker | no |
| Small molecule | Caffeic acid |
| Small molecule CAS | 331-39-5 |
| Small molecule structure | |
| Calculated properties | |
|---|---|
| LogP | -2.30387 |
| Rotatable bonds | 19 |
| H bond donor | 10 |
| H bond acceptor | 11 |
| Polar surface area (PSA) | 290.37000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
Synthesis of small molecule-peptide conjugates as potential whitening agents | 2012 | Lee, Hye-Suk; Shin, Kyong-Hoon; Ryu, Geun-Seok; Chi, Gyeong-Yup; Cho, In-Shik; Kim, Han-Young | Bulletin of the Korean Chemical Society | ||
