conjupepdb_log

View Conjugates details

ConjuPepDB ID: cpd00895

Chemical structure


molecule
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cpd00895


Schematic Help Icon Schematic representation of peptide, linker and drug in the peptide-drug conjugates
VHG Kanamycin A derivative
Identification
ConjuPepDB ID

cpd00895

Smiles
Inchi Key

InChIKey=WSPNZNWVTASAGI-LNZLDOKNSA-N

Molecular weight

1234.65

Molecular formula

C54H94N10O22

Chemical name
Peptide information
Sequence (one letter)

VHG

Length

3

Peptide name

tripeptide

External ID
CAS number

1232235-97-0

Other information
Application

Antimicrobial therapy, antibacterial (P. aeruginosa)

Additional function

Overcome drug resistance

Conjugate type

triazole

Linker

no

Small molecule

Kanamycin A derivative

Small molecule CAS

953395-50-1

Small molecule structure

Calculated properties
LogP

-0.97398

Rotatable bonds

29

H bond donor

13

H bond acceptor

20

Polar surface area (PSA)

452.85000

Citations
ID Title Year Authors Journal DOI

Cpdart0126

Evaluation of amphiphilic aminoglycoside-peptide triazole conjugates as antibacterial agents

2010

Bera, Smritilekha; Zhanel, George G.; Schweizer, Frank

Bioorganic & Medicinal Chemistry

..