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Chemical structure of GSK429286A

GC18119

GSK429286A

Also known as N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydro-1H-pyridine-5-carboxamide

Selective ROCK1/ROCK2 inhibitor

ChemicalCAS864082-47-3MW432.37FormulaC21H16F4N4O2
CAS number
864082-47-3
Molecular weight
432.37
Formula
C21H16F4N4O2
Solubility
≥ 21·6mg/mL in DMSO, ≥ 2·73 mg/mL in EtOH with ultrasonic and warming
InChIKey
OLIIUAHHAZEXEX-UHFFFAOYSA-N
Catalogue number
GC18119
Brand
GLPBIO
Computed properties PubChem CID 11373846 · XLogP 2.9 · TPSA 86.9 Ų · H-bond donors 3
XLogP
2.9
TPSA
86.9 Ų
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
3
Heavy atoms
31

SMILES CC1=C(C(CC(=O)N1)C2=CC=C(C=C2)C(F)(F)F)C(=O)NC3=C(C=C4C(=C3)C=NN4)F

Computed descriptors from PubChem (CID 11373846), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
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