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View Conjugates details

ConjuPepDB ID: cpd01306

Chemical structure


molecule
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cpd01306


Schematic Help Icon Schematic representation of peptide, linker and drug in the peptide-drug conjugates
CGYGPKKKRKVGG N-[5-[[12-[(6-chloro-2-methoxy-9-acridinyl)amino]-1-oxododecyl]amino]pentyl]-4-[(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)methyl]-cyclohexanecarboxamide
Identification
ConjuPepDB ID

cpd01306

Smiles
Molecular weight

2094.14

Molecular formula

C100H156ClN25O20S

Chemical name
Peptide information
Sequence (one letter)

CGYGPKKKRKVGG

Length

13

Peptide name

N/A

External ID
CAS number

872979-89-0

Other information
Application

DNA binding

Additional function

Transport into the nucleus

Pharmacological class

other

Conjugate type

sulfide

Linker

no

Small molecule

N-[5-[[12-[(6-chloro-2-methoxy-9-acridinyl)amino]-1-oxododecyl]amino]pentyl]-4-[(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)methyl]-cyclohexanecarboxamide

Small molecule CAS

872854-01-8

Structure method

1H and 13C NMR, HPLC

NMR solvent

CDCl3

Calculated properties
LogP

-4.02127

Rotatable bonds

70

H bond donor

24

H bond acceptor

30

Polar surface area (PSA)

719.67000

Citations
ID Title Year Authors Journal DOI

cpdart0200

Synthesis of acridine-nuclear localization signal (NLS) conjugates and evaluation of their impact on lipoplex and polyplex-based transfection

2005

Boulanger, Caroline; Di Giorgio, Christophe; Vierling, Pierre

European Journal of Medicinal Chemistry

..