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Schematic representation of peptide, linker and drug in the peptide-drug conjugates
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|---|---|---|---|---|
| XVPX | Acyclovir (ACV) |
| Identification | |
|---|---|
| ConjuPepDB ID | cpd00555 |
| Smiles | |
| Inchi Key | InChIKey=PNJCXAXPAAKGCZ-SFTDATJTSA-N |
| Molecular weight | 597.255 |
| Molecular formula | C28H35N7O8 |
| Chemical name | Peptide information |
| Sequence (one letter) | XVPX |
| Length | 4 |
| Peptide name | dipeptide |
| External ID | |
|---|---|
| CAS number | 791111-94-9 |
| Other information | |
|---|---|
| Application | Antimicrobial therapy, antiviral (HSV-1 and 2), prodrug |
| Additional function | Improve activity and water solubility |
| Pharmacological class | antimicrobial, antiviral |
| Conjugate type | amide |
| Linker | no |
| Small molecule | Acyclovir (ACV) |
| Small molecule CAS | 59277-89-3 |
| Small molecule structure | |
| Structure method | 1H NMR |
| Calculated properties | |
|---|---|
| LogP | 1.77150 |
| Rotatable bonds | 14 |
| H bond donor | 3 |
| H bond acceptor | 9 |
| Polar surface area (PSA) | 182.55000 |
| Citations | |||||
|---|---|---|---|---|---|
| ID | Title | Year | Authors | Journal | DOI |
Novel water-soluble prodrugs of acyclovir cleavable by the dipeptidyl-peptidase IV (DPP IV/CD26) enzyme | 2013 | Diez-Torrubia, Alberto; Cabrera, Silvia; de Castro, Sonia; Garcia-Aparicio, Carlos; Mulder, Gwenn; De Meester, Ingrid; Camarasa, Maria-Jose; Balzarini, Jan; Velazquez, Sonsoles | European Journal of Medicinal Chemistry | ||
