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View Conjugates details

ConjuPepDB ID: cpd00874

Chemical structure


molecule
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cpd00874


Schematic Help Icon Schematic representation of peptide, linker and drug in the peptide-drug conjugates
WRRRR Deacetylvinblastine
Identification
ConjuPepDB ID

cpd00874

Smiles
Inchi Key

InChIKey=JGZUBNNBAOFEJI-OBZKBKMZSA-N

Molecular weight

1564.88

Molecular formula

C78H112N22O13

Chemical name
Peptide information
Sequence (one letter)

WRRRR

Length

5

Peptide name

polyarginine

External ID
CAS number

1256091-90-3

Other information
Application

Anticancer therapy

Additional function

Improve cell penetration

Conjugate type

amide

Linker

no

Small molecule

Deacetylvinblastine

Small molecule CAS

3352-69-0

Small molecule structure

Structure method

1H, 2D-GHSQCAD, GCOSY, 2D-GHMBCAD, and 2D-ROESY

Calculated properties
LogP

-3.52217

Rotatable bonds

35

H bond donor

19

H bond acceptor

27

Polar surface area (PSA)

577.92000

Citations
ID Title Year Authors Journal DOI

Cpdart0124

Synthesis and in Vitro Antitumor Effect of Vinblastine Derivative-Oligoarginine Conjugates

2010

Banoczi, Zoltan; Gorka-Kereskenyi, Almos; Remenyi, Judit; Orban, Erika; Hazai, Laszlo; Tokesi, Natalia; Olah, Judit; Ovadi, Judit; Beni, Zoltan; Hada, Viktor; Szantay, Csaba Jr.; Hudecz, Ferenc; Kalaus, Gyorgy; Szantay, Csaba

Bioconjugate Chemistry

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