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Chemical structure of GSK2879552 dihydrochloride

GC62719

GSK2879552 dihydrochloride

Also known as 4-[[4-[[[(1R,2S)-2-phenylcyclopropyl]amino]methyl]piperidin-1-yl]methyl]benzoic acid;dihydrochloride

GSK2879552 dihydrochloride an orally active, selective and irreversible inhibitor of lysine specific demethylase 1 (LSD1/KDM1A), with potential antineoplastic activity

ChemicalCAS1902123-72-1MW437.4FormulaC23H30Cl2N2O2
CAS number
1902123-72-1
Molecular weight
437.4
Formula
C23H30Cl2N2O2
Solubility
DMSO ： 50 mg/mL (114·31 mM; Need ultrasonic)
InChIKey
QEKGSBZKRLHQSZ-VSIGASKDSA-N
Catalogue number
GC62719
Brand
GLPBIO
Computed properties PubChem CID 121272425 · TPSA 52.6 Ų · H-bond donors 4 · H-bond acceptors 4
TPSA
52.6 Ų
H-bond donors
4
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
29

SMILES C1CN(CCC1CN[C@@H]2C[C@H]2C3=CC=CC=C3)CC4=CC=C(C=C4)C(=O)O.Cl.Cl

Computed descriptors from PubChem (CID 121272425), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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