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Chemical structure of AF40431

GC38586

AF40431

Also known as (2S)-2-[(7-hydroxy-4-methyl-2-oxochromen-8-yl)methylamino]-4-methylpentanoic acid

AF40431, the first reported small-molecule ligand of sortilin, has an IC50 of 4·4 ?M and a Kd of 0·7 ?M

ChemicalCAS181125-92-8MW319.35FormulaC17H21NO5
CAS number
181125-92-8
Molecular weight
319.35
Formula
C17H21NO5
Solubility
DMSO： 25 mg/mL (78·28 mM; ultrasonic and adjust pH to 1 with TFA)
InChIKey
YPJLUCAXHFPZJD-ZDUSSCGKSA-N
Catalogue number
GC38586
Brand
GLPBIO
Computed properties PubChem CID 5391672 · XLogP 0.4 · TPSA 95.9 Ų · H-bond donors 3
XLogP
0.4
TPSA
95.9 Ų
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
23

SMILES CC1=CC(=O)OC2=C1C=CC(=C2CN[C@@H](CC(C)C)C(=O)O)O

Computed descriptors from PubChem (CID 5391672), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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