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Schematic representation of peptide, linker and drug in the peptide-drug conjugates
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|---|---|---|---|---|
| CGRKKRRQRRRPPQ | doxorubicin |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd00005 |
| Smiles | |
| Inchi Key | InChIKey=NQFYJZWFBNOHQP-SGQBORPBSA-N |
| Molecular weight | 2930.48 |
| Molecular formula | C128H199N43O35S |
| Chemical name | Peptide information |
| Sequence (one letter) | CGRKKRRQRRRPPQ |
| Length | 14 |
| Peptide name | N/A |
| External ID | |
|---|---|
| CAS number | 1912378-06-3 |
| Other information | |
|---|---|
| Application | Anticancer therapy, HepG2 human liver cancer cells |
| Additional function | Improve activity |
| Pharmacological class | anticancer |
| Conjugate type | amide |
| Linker | no |
| Small molecule | doxorubicin |
| Small molecule CAS | 23214-92-8 |
| Small molecule structure | |
| Structure method | NMR |
| NMR solvent | DMSO-d6 |
| Calculated properties | |
|---|---|
| LogP | -16.88797 |
| Rotatable bonds | 88 |
| H bond donor | 39 |
| H bond acceptor | 55 |
| Polar surface area (PSA) | 1320.46000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
Controlled release of free doxorubicin from peptide-drug conjugates by drug loading. | 2014 | Chen, Zhipeng; Zhang, Pengcheng; Cheetham, Andrew G; Moon, Jae Hyon; Moxley, James W Jr; Lin, Yi-an; Cui, Honggang | Journal of controlled release : official journal of the Controlled Release Society | ||
