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Chemical structure of Razuprotafib

GC62687

Razuprotafib

Also known as [4-[(2S)-2-[[(2S)-2-(methoxycarbonylamino)-3-phenylpropanoyl]amino]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)ethyl]phenyl]sulfamic acid

Razuprotafib (AKB-9778) is a potent and selective inhibitor of the catalytic activity of VE-PTP (vascular endothelial protein tyrosine phosphatase) with an IC50of 17 pM

ChemicalCAS1008510-37-9MW586.7FormulaC26H26N4O6S3
CAS number
1008510-37-9
Molecular weight
586.7
Formula
C26H26N4O6S3
Solubility
DMSO : 100 mg/mL (170·44 mM; Need ultrasonic)
InChIKey
KWJDHELCGJFUHW-SFTDATJTSA-N
Catalogue number
GC62687
Brand
GLPBIO
Computed properties PubChem CID 46700782 · XLogP 3.7 · TPSA 212 Ų · H-bond donors 4
XLogP
3.7
TPSA
212 Ų
H-bond donors
4
H-bond acceptors
10
Rotatable bonds
12
Heavy atoms
39

SMILES COC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC2=CC=C(C=C2)NS(=O)(=O)O)C3=CSC(=N3)C4=CC=CS4

Computed descriptors from PubChem (CID 46700782), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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