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Chemical structure of SORT-PGRN interaction inhibitor 1

GC61739

SORT-PGRN interaction inhibitor 1

Also known as 1-benzyl-3-tert-butylpyrazole-5-carboxylic acid

SORT-PGRN interaction inhibitor 1 is a potent inhibitor of the sortilin-progranulin interaction with an IC50 of 2 μM

ChemicalCAS100957-85-5MW258.32FormulaC15H18N2O2
CAS number
100957-85-5
Molecular weight
258.32
Formula
C15H18N2O2
InChIKey
IJXYLILRNVOJNF-UHFFFAOYSA-N
Catalogue number
GC61739
Brand
GLPBIO
Computed properties PubChem CID 2744515 · XLogP 3.4 · TPSA 55.1 Ų · H-bond donors 1
XLogP
3.4
TPSA
55.1 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
19

SMILES CC(C)(C)C1=NN(C(=C1)C(=O)O)CC2=CC=CC=C2

Computed descriptors from PubChem (CID 2744515), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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