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Schematic representation of peptide, linker and drug in the peptide-drug conjugates
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| YPSXXRHYINLTRQRY | 1-Fluoro-2-cyclooctyne-1-carboxylic acid + DOTA (1,4,7,10-tetraazacyclododecane-1,4,7,10-tetraacetic acid) derivative) |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd00928 |
| Smiles | |
| Inchi Key | InChIKey=SNXQMJCDIOLXFP-QFRFTRQHSA-N |
| Molecular weight | 2730.46 |
| Molecular formula | C123H192FN39O31 |
| Chemical name | Peptide information |
| Sequence (one letter) | YPSXXRHYINLTRQRY |
| Length | 16 |
| Peptide name | Neuropeptide Y derivative |
| External ID | |
|---|---|
| CAS number | 1246180-10-8 |
| Other information | |
|---|---|
| Application | Synthesis of radiolabeled conjugates |
| Additional function | Potential targeted imaging agents |
| Conjugate type | triazole |
| Linker | no |
| Small molecule | 1-Fluoro-2-cyclooctyne-1-carboxylic acid + DOTA (1,4,7,10-tetraazacyclododecane-1,4,7,10-tetraacetic acid) derivative) |
| Small molecule CAS | 1246180-12-0 |
| Small molecule structure | |
| Calculated properties | |
|---|---|
| LogP | -15.93320 |
| Rotatable bonds | 82 |
| H bond donor | 35 |
| H bond acceptor | 48 |
| Polar surface area (PSA) | 1119.80000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
A DOTA-peptide conjugate by copper-free click chemistry | 2010 | Martin, Molly E.; Parameswarappa, Sharavathi G.; O'Dorisio, M. Sue; Pigge, F. Christopher; Schultz, Michael K. | Bioorganic & Medicinal Chemistry | ||
