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Schematic representation of peptide, linker and drug in the peptide-drug conjugates
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|---|---|---|---|---|
| RLWVLWRR | Cephalothin |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd00638 |
| Smiles | |
| Inchi Key | InChIKey=RTVWIVCTZSOOHO-WIGLELATSA-N |
| Molecular weight | 2139.08 |
| Molecular formula | C106H154N20O21S3 |
| Chemical name | Peptide information |
| Sequence (one letter) | RLWVLWRR |
| Length | 8 |
| Peptide name | antibacterial peptide |
| External ID | |
|---|---|
| CAS number | 1416725-87-5 |
| Other information | |
|---|---|
| Application | Antimicrobial therapy, antibacterial |
| Additional function | Targeting beta lactamase, overcome drug resistance |
| Conjugate type | sulfonamide |
| Linker | no |
| Small molecule | Cephalothin |
| Small molecule CAS | 153-61-7 |
| Small molecule structure | |
| Structure method | 1H-NMR |
| NMR solvent | DMSO-d6 |
| Calculated properties | |
|---|---|
| LogP | 11.84012 |
| Rotatable bonds | 43 |
| H bond donor | 15 |
| H bond acceptor | 26 |
| Polar surface area (PSA) | 616.61000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
β-Lactam-host defence peptide conjugates as antibioticprodrug candidates targeting resistant bacteria | 2012 | Desgranges, Stephane; Ruddle, Carol C.; Burke, Liam P.; McFadden, Tara M.; O'Brien, John E.; Fitzgerald-Hughes, Deirdre; Humphreys, Hilary; Smyth, Timothy P.; Devocelle, Marc | RSC Advances | ||
