conjupepdb_log

View Conjugates details

ConjuPepDB ID: cpd00206

Chemical structure


molecule
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cpd00206


Schematic Help Icon Schematic representation of peptide, linker and drug in the peptide-drug conjugates
XEYAARIEALIRAAQEQQKKNEE triazole N-carboxyphenylpyrrole compound Gls-22
Identification
ConjuPepDB ID

cpd00206

Smiles
Inchi Key

InChIKey=TWCNCXBAXVORLA-JJTFZWKPNA-N

Molecular weight

3139.55

Molecular formula

C140H210N40O43

Chemical name
Peptide information
Sequence (one letter)

XEYAARIEALIRAAQEQQKKNEE

Length

23

Peptide name

T2635-truncated peptide (HIV-1 fusion inhibitor)

External ID
CAS number

1975225-65-0

Other information
Application

Antimicrobial, antiviral (HIV-1)

Pharmacological class

antimicrobial, antiviral

Conjugate type

amide

Linker

N/A

Linker Type

triazole

Small molecule

N-carboxyphenylpyrrole compound Gls-22

Small molecule CAS

1975225-54-7

Small molecule structure

Structure method

1H- anf 13C-NMR

NMR solvent

CDCl3

Calculated properties
LogP

-16.38232

Rotatable bonds

107

H bond donor

41

H bond acceptor

52

Polar surface area (PSA)

1371.56000

Citations
ID Title Year Authors Journal DOI

Cpdart0045

An effective conjugation strategy for designing short peptide-based HIV-1 fusion inhibitors

2016

Liang, Guodong; Wang, Huixin; Chong, Huihui; Cheng, Siqi; Jiang, Xifeng; He, Yuxian; Wang, Chao; Liu, Keliang

Organic & Biomolecular Chemistry

..