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Schematic representation of peptide, linker and drug in the peptide-drug conjugates
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| XVVX | triazole | 4-[(Ethenylsulfonyl)methylamino]-N-2-propyn-1-ylbenzamide |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd00067 |
| Smiles | |
| Inchi Key | InChIKey=JPIYHMOIKPXCIZ-OAOQBLPOSA-N |
| Molecular weight | 1166.64 |
| Molecular formula | C58H90N10O13S |
| Chemical name | Peptide information |
| Sequence (one letter) | XVVX |
| Length | 4 |
| Peptide name | tripeptide |
| External ID | |
|---|---|
| CAS number | 2247055-79-2 |
| Other information | |
|---|---|
| Application | Synthesis, cysteine-Selective conjugation to prepare antibody-drog conjugates |
| Additional function | Posible applications as various imaging and therapeutic conjugates |
| Pharmacological class | anticancer |
| Conjugate type | amide |
| Linker | N/A |
| Linker Type | triazole |
| Small molecule | 4-[(Ethenylsulfonyl)methylamino]-N-2-propyn-1-ylbenzamide |
| Small molecule CAS | 2247055-83-8 |
| Small molecule structure | |
| Calculated properties | |
|---|---|
| LogP | 2.96035 |
| Rotatable bonds | 33 |
| H bond donor | 4 |
| H bond acceptor | 15 |
| Polar surface area (PSA) | 273.47000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
N-Methyl-N-phenylvinylsulfonamides for Cysteine-Selective Conjugation | 2018 | Huang, Rong; Li, Zhihong; Sheng, Yao; Yu, Jianghui; Wu, Yue; Zhan, Yuexiong; Chen, Hongli; Jiang, Biao | Organic Letters | ||
