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Schematic representation of peptide, linker and drug in the peptide-drug conjugates
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|---|---|---|---|---|
| YSAYPDSVPMMSK | triazole | paclitaxel (PTX) derivative |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd00440 |
| Smiles | |
| Inchi Key | InChIKey=RIYHTJRLFKFNBR-UHUMTRIJSA-N |
| Molecular weight | 2663.13 |
| Molecular formula | C128H170N18O40S2 |
| Chemical name | Peptide information |
| Sequence (one letter) | YSAYPDSVPMMSK |
| Length | 13 |
| Peptide name | ephrin type-A receptor 2 (EphA2) targeting peptide |
| External ID | |
|---|---|
| CAS number | 1246194-69-3 |
| Other information | |
|---|---|
| Application | Anticancer therapy |
| Additional function | Targeting EphA2 receptor |
| Pharmacological class | anticancer |
| Conjugate type | amide |
| Linker | N/A |
| Linker Type | triazole |
| Small molecule | paclitaxel (PTX) derivative |
| Small molecule CAS | 114655-02-6 |
| Small molecule structure | |
| Calculated properties | |
|---|---|
| LogP | -2.97775 |
| Rotatable bonds | 76 |
| H bond donor | 22 |
| H bond acceptor | 37 |
| Polar surface area (PSA) | 856.09000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
Design, Synthesis and Bioevaluation of an EphA2 Receptor-Based Targeted Delivery System | 2014 | Barile, Elisa; Wang, Si; Das, Swadesh K.; Noberini, Roberta; Dahl, Russell; Stebbins, John L.; Pasquale, Elena B.; Fisher, Paul B.; Pellecchia, Maurizio | ChemMedChem | ||
