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Chemical structure of nSMase2-IN-1

GC75562

nSMase2-IN-1

Also known as N,N-dimethyl-5-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-3-amine

nSMase2-IN-1 is an orally active Neutral sphingomyelinase 2 (nSMase2) inhibitor with an IC50 value of 0·13 ± 0·06 μM· nSMase2-IN-1 is metabolically stable in liver microsomes and orally available with a favorable brain-to-plasma ratio· nSMase2-IN-1 can be used for nervous system disease research

ChemicalCAS2968322-24-7MW247.3FormulaC12H17N5O
CAS number
2968322-24-7
Molecular weight
247.3
Formula
C12H17N5O
InChIKey
JOXWMNJMLFTCMT-UHFFFAOYSA-N
Catalogue number
GC75562
Brand
GLPBIO
Computed properties PubChem CID 168510320 · XLogP 0.5 · TPSA 45.9 Ų · H-bond donors 0
XLogP
0.5
TPSA
45.9 Ų
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
18

SMILES CN(C)C1=C2N=C(C=CN2N=C1)N3CCOCC3

Computed descriptors from PubChem (CID 168510320), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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