conjupepdb_log

View Conjugates details

ConjuPepDB ID: cpd01616

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.

cpd01616


Schematic Help Icon Schematic representation of peptide, linker and drug in the peptide-drug conjugates
GGL 4-Carboxybenzenesulfonamide
Identification
ConjuPepDB ID

cpd01616

Smiles
Molecular weight

428.137

Molecular formula

C17H24N4O7S

Chemical name
Peptide information
Sequence (one letter)

GGL

Length

3

Peptide name

tripeptide

External ID
CAS number

176170-92-6

Other information
Application

Synthesis

Additional function

Using conjugates as probes for secondary binding sites in carbonic anhydrase

Pharmacological class

other

Conjugate type

amide

Linker

no

Small molecule

4-Carboxybenzenesulfonamide

Small molecule CAS

138-41-0

Small molecule structure

Structure method

NMR and HMRS

Calculated properties
LogP

-1.25612

Rotatable bonds

10

H bond donor

5

H bond acceptor

7

Polar surface area (PSA)

184.76000

Citations
ID Title Year Authors Journal DOI

cpdart0246

Benzenesulfonamide-peptide conjugates as probes for secondary binding sites near the active site of carbonic anhydrase

1996

Sigal, George B.; Whitesides, George M.

Bioorganic & Medicinal Chemistry Letters

..