conjupepdb_log

View Conjugates details

ConjuPepDB ID: cpd00002

Chemical structure


molecule
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cpd00002


Schematic Help Icon Schematic representation of peptide, linker and drug in the peptide-drug conjugates
RWRWRWRW glutaric acid doxorubicin
Identification
ConjuPepDB ID

cpd00002

Smiles
Inchi Key

InChIKey=BAAHWYPUCXORMD-VREYHHINSA-N

Molecular weight

2024.94

Molecular formula

C100H124N26O21

Chemical name
Peptide information
Sequence (one letter)

RWRWRWRW

Length

8

Peptide name

N/A

External ID
CAS number

1417821-47-6

Other information
Application

Anticancer therapy (prodrug)

Additional function

Targeting

Pharmacological class

anticancer

Conjugate type

amide

Linker

N/A

Linker Type

glutaric acid

Small molecule

doxorubicin

Small molecule CAS

23214-92-8

Small molecule structure

Structure method

NMR

NMR solvent

DMSO-d6

Calculated properties
LogP

-0.64034

Rotatable bonds

51

H bond donor

26

H bond acceptor

33

Polar surface area (PSA)

808.79000

Citations
ID Title Year Authors Journal DOI

cpdart0005

Design and biological evaluation of cell-penetrating peptide-doxorubicin conjugates as prodrugs.

2013

Nasrolahi Shirazi, Amir; Tiwari, Rakesh; Chhikara, Bhupender S; Mandal, Dindyal; Parang, Keykavous

Molecular pharmaceutics

..