conjupepdb_log

View Conjugates details

ConjuPepDB ID: cpd00162

Chemical structure


molecule
3D viewer Help Icon Use the buttons at the bottom of Jsmol viewer to see different representations, ON/OFF Hydrogens, and ON/OFF rotation.

3D model is for representation purpose only.

cpd00162


Schematic Help Icon Schematic representation of peptide, linker and drug in the peptide-drug conjugates
RCKRWRWKWRW propanamide Doxorubicin & Curcumine
Identification
ConjuPepDB ID

cpd00162

Smiles
Inchi Key

InChIKey=BDIOFZVHIQRJBP-PLESVWNQSA-N

Molecular weight

2989.31

Molecular formula

C147H184N32O33S2

Chemical name
Peptide information
Sequence (one letter)

RCKRWRWKWRW

Length

11

Peptide name

[C(WR)4K2(b-A)]

External ID
CAS number

2148902-16-1

Other information
Application

Anticancer therapy, CCRF-CEM, SKOV-3, LLCPK cells

Additional function

Improve cell-penetration, nuclear targeting and solubility

Pharmacological class

anticancer

Conjugate type

disulfide

Linker

N/A

Linker Type

propanamide

Small molecule

Doxorubicin & Curcumine

Small molecule CAS

23214-92-8

Small molecule structure

Small molecule CAS 2

458-37-7

Small molecule structure 2

Calculated properties
LogP

2.27262

Rotatable bonds

66

H bond donor

35

H bond acceptor

45

Polar surface area (PSA)

1055.61000

Citations
ID Title Year Authors Journal DOI

Cpdart0038

Cyclic peptide conjugate of curcumin and doxorubicin as an anticancer agent

2017

Darwish, Shaban; Mozaffari, Saghar; Parang, Keykavous; Tiwari, Rakesh

Tetrahedron Letters

..