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Schematic representation of peptide, linker and drug in the peptide-drug conjugates
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|---|---|---|---|---|
| XIVD | triazole | Propiolic acid |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd00359 |
| Smiles | |
| Inchi Key | InChIKey=MKZNYPOKRXZZGK-WKIXKZOFNA-L |
| Molecular weight | 905.325 |
| Molecular formula | C31H50N8O9[O-]2[Pt+2] |
| Chemical name | Peptide information |
| Sequence (one letter) | XIVD |
| Length | 4 |
| Peptide name | tripeptide |
| External ID | |
|---|---|
| CAS number | 1616793-10-2 |
| Other information | |
|---|---|
| Application | Anticancer therapy, breast cancer |
| Additional function | Localization, lower systemic toxicity |
| Pharmacological class | anticancer |
| Conjugate type | amide |
| Linker | N/A |
| Linker Type | triazole |
| Small molecule | Propiolic acid |
| Small molecule CAS | 471-25-0 |
| Small molecule structure | |
| Calculated properties | |
|---|---|
| LogP | -8.42771 |
| Rotatable bonds | 16 |
| H bond donor | 7 |
| H bond acceptor | 13 |
| Polar surface area (PSA) | 278.43000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
Ligation of anti-cancer drugs to self-assembling ultrashort peptides by click chemistry for localized therapy | 2014 | Reithofer, Michael R.; Chan, Kiat-Hwa; Lakshmanan, Anupama; Lam, Dang Hoang; Mishra, Archana; Gopalan, Began; Joshi, Mangesh; Wang, Shu; Hauser, Charlotte A. E. | Chemical Science | ||
