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Chemical structure of PF-05175157

GC19284

PF-05175157

Also known as 1'-(2-methyl-3H-benzimidazole-5-carbonyl)-1-propan-2-ylspiro[4,6-dihydroindazole-5,4'-piperidine]-7-one

PF-05175157 is broad spectrum acetyl-CoA carboxylase (ACC) inhibitor with IC50s of 27·0, 33·0, 23·5 and 50·4 nM for ACC1 (human), ACC2 (human), ACC1 (rat), ACC2 (rat), respectively

ChemicalCAS1301214-47-0MW405.49FormulaC23H27N5O2
CAS number
1301214-47-0
Molecular weight
405.49
Formula
C23H27N5O2
Solubility
DMSO ： 30 mg/mL (73·98 mM)
InChIKey
BDXXSFOJPYSYOC-UHFFFAOYSA-N
Catalogue number
GC19284
Brand
GLPBIO
Computed properties PubChem CID 52934180 · XLogP 2.7 · TPSA 83.9 Ų · H-bond donors 1
XLogP
2.7
TPSA
83.9 Ų
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
30

SMILES CC1=NC2=C(N1)C=C(C=C2)C(=O)N3CCC4(CC3)CC5=C(C(=O)C4)N(N=C5)C(C)C

Computed descriptors from PubChem (CID 52934180), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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Documents
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