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Chemical structure of Halofuginone hydrobromide, (-)-

GC31950

Halofuginone hydrobromide, (-)-

Also listed as Halofuginone hydrobromide (RU-19110 (hydrobromide))

Halofuginone (RU-19110) hydrobromid, a Febrifugine derivative, is a competitive prolyl-tRNA synthetase inhibitor with a Ki of 18·3 nM

ChemicalCAS64924-67-0MW495.59FormulaC16H18Br2ClN3O3
CAS number
64924-67-0
Molecular weight
495.59
Formula
C16H18Br2ClN3O3
Solubility
DMSO ： 50 mg/mL (100·89 mM)
InChIKey
SJUWEPZBTXEUMU-LDXVYITESA-N
Catalogue number
GC31950
Brand
GLPBIO
Computed properties PubChem CID 400771 · TPSA 82 Ų · H-bond donors 3 · H-bond acceptors 5
TPSA
82 Ų
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
25

SMILES C1C[C@H]([C@@H](NC1)CC(=O)CN2C=NC3=CC(=C(C=C3C2=O)Cl)Br)O.Br

Computed descriptors from PubChem (CID 400771), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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