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View Conjugates details

ConjuPepDB ID: cpd00558

Chemical structure


molecule
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cpd00558


Schematic Help Icon Schematic representation of peptide, linker and drug in the peptide-drug conjugates
XVPVPX Acyclovir (ACV)
Identification
ConjuPepDB ID

cpd00558

Smiles
Inchi Key

InChIKey=YJCQGQIKEXMWTG-ZJZGAYNASA-N

Molecular weight

677.329

Molecular formula

C33H43N9O7

Chemical name
Peptide information
Sequence (one letter)

XVPVPX

Length

6

Peptide name

tetrapeptide

External ID
CAS number

1520867-30-4

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

1.86011

Rotatable bonds

12

H bond donor

5

H bond acceptor

9

Polar surface area (PSA)

207.29000

Citations
ID Title Year Authors Journal DOI

Cpdart0088

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

..