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Schematic representation of peptide, linker and drug in the peptide-drug conjugates
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|---|---|---|---|---|
| XHWSHDWKPG | L-Pyroglutamic acid |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd00454 |
| Smiles | |
| Inchi Key | InChIKey=CKAZAFTXQPBKJJ-RJEWGMQKSA-N |
| Molecular weight | 1448.6 |
| Molecular formula | C65H84N20O17S |
| Chemical name | Peptide information |
| Sequence (one letter) | XHWSHDWKPG |
| Length | 10 |
| Peptide name | N/A |
| External ID | |
|---|---|
| CAS number | 1428670-72-7 |
| Other information | |
|---|---|
| Application | Anticancer therapy, breast cancer cells (MCF-7) |
| Additional function | Improve effect and stability |
| Pharmacological class | anticancer |
| Conjugate type | amide |
| Linker | no |
| Small molecule | L-Pyroglutamic acid |
| Small molecule CAS | 98-79-3 |
| Small molecule structure | |
| Calculated properties | |
|---|---|
| LogP | -8.90735 |
| Rotatable bonds | 39 |
| H bond donor | 19 |
| H bond acceptor | 20 |
| Polar surface area (PSA) | 556.43000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
Synthesis, enzymatic stability and in vitro cytostatic effect of Daunorubicin-GnRH-III derivative dimers | 2013 | Schreier, Verena Natalie; Mezo, Gabor; Orban, Erika; Duerr, Claudia; Marquardt, Andreas; Manea, Marilena | Bioorganic & Medicinal Chemistry Letters | ||
