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View Conjugates details

ConjuPepDB ID: cpd00740

Chemical structure


molecule
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cpd00740


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

cpd00740

Smiles
Inchi Key

InChIKey=UZZCKYZRWCERCT-KPBGDJOUSA-N

Molecular weight

1552.75

Molecular formula

C68H104N20O20S

Chemical name
Peptide information
Sequence (one letter)

IELLQARGGC

Length

10

Peptide name

lung-targeting peptide

External ID
CAS number

1350616-74-8

Other information
Application

Anticancer therapy, NCI-H358 and HL-60 cells

Additional function

Improve specificity and lung targeting

Conjugate type

sulfide

Linker

no

Small molecule

Pemetrexed

Small molecule CAS

137281-23-3

Small molecule structure

Calculated properties
LogP

-6.17061

Rotatable bonds

51

H bond donor

19

H bond acceptor

24

Polar surface area (PSA)

643.85000

Citations
ID Title Year Authors Journal DOI

Cpdart0115

New pemetrexed-peptide conjugates: synthesis, characterization and in vitro cytostatic effect on non-small cell lung carcinoma (NCI-H358) and human leukemia (HL-60) cells

2011

Miklan, Zsanett; Orban, Erika; Banoczi, Zoltan; Hudecz, Ferenc

Journal of Peptide Science

..