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Schematic representation of peptide, linker and drug in the peptide-drug conjugates
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| XGLRKRLRKFRNKIKEK | 1,4,7-Triazacyclononane-1-glutaric acid-4,7-acetic acid |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd00136 |
| Smiles | |
| Inchi Key | InChIKey=ZMOFASPUHYSEDP-NMUVMTTQSA-N |
| Molecular weight | 3254.9 |
| Molecular formula | C144H247N49O37 |
| Chemical name | Peptide information |
| Sequence (one letter) | XGLRKRLRKFRNKIKEK |
| Length | 17 |
| Peptide name | N/A |
| External ID | |
|---|---|
| CAS number | 2098381-23-6 |
| Other information | |
|---|---|
| Application | Antitumor therapy, MCF-7 cells |
| Additional function | Targeting hypoxic cells, Improve stability Fluorescence- and Radiolabel imaging via chelation |
| Pharmacological class | anticancer |
| Conjugate type | amine |
| Linker | no |
| Small molecule | 1,4,7-Triazacyclononane-1-glutaric acid-4,7-acetic acid |
| Small molecule CAS | 1092370-12-1 |
| Small molecule structure | |
| Calculated properties | |
|---|---|
| LogP | -14.67910 |
| Rotatable bonds | 119 |
| H bond donor | 37 |
| H bond acceptor | 54 |
| Polar surface area (PSA) | 1344.34000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
Biological characterization of novel nitroimidazole-peptide conjugates in vitro and in vivo | 2017 | Bergmann, Ralf; Splith, Katrin; Pietzsch, Jens; Bachmann, Michael; Neundorf, Ines | Journal of Peptide Science | ||
