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ConjuPepDB ID: cpd01294

Chemical structure


molecule
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cpd01294


Schematic Help Icon Schematic representation of peptide, linker and drug in the peptide-drug conjugates
CRRMKWKK maleimide Paclitaxel
Identification
ConjuPepDB ID

cpd01294

Smiles
Molecular weight

2138

Molecular formula

C103H143N21O25S2

Chemical name
Peptide information
Sequence (one letter)

CRRMKWKK

Length

8

Peptide name

Penetratin fragment

External ID
CAS number

888716-38-9

Other information
Application

Anticancer therapy, human lung and breast cancer cell lines

Additional function

Improving solubility an cell penetration

Pharmacological class

anticancer

Conjugate type

sulfide

Linker

N/A

Linker Type

maleimide

Small molecule

Paclitaxel

Small molecule CAS

33069-62-4

Structure method

1H and 13C NMR, RP-HPLC

NMR solvent

CDCl5

Calculated properties
LogP

-1.87479

Rotatable bonds

62

H bond donor

22

H bond acceptor

30

Polar surface area (PSA)

755.20000

Citations
ID Title Year Authors Journal DOI

cpdart0197

Synthesis and biological activity of conjugates between paclitaxel and the cell delivery vector penetratin

2006

Wang, Shudong; Zhelev, Nikolai Z.; Duff, Susan; Fischer, Peter M.

Bioorganic & Medicinal Chemistry

..