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Chemical structure of (E/Z)-ZINC09659342

GC64657

(E/Z)-ZINC09659342

Also known as 4-[(4E)-3-methyl-5-oxo-4-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methylidene]pyrazol-1-yl]benzoic acid

(E/Z)-ZINC09659342 is an inhibitor of Lbc-RhoA interaction

ChemicalCAS591726-26-0MW440.37FormulaC23H15F3N2O4
CAS number
591726-26-0
Molecular weight
440.37
Formula
C23H15F3N2O4
InChIKey
SFVRJPWNVAZKMP-XDHOZWIPSA-N
Catalogue number
GC64657
Brand
GLPBIO
Computed properties PubChem CID 98215399 · XLogP 4.6 · TPSA 83.1 Ų · H-bond donors 1
XLogP
4.6
TPSA
83.1 Ų
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
4
Heavy atoms
32

SMILES CC\1=NN(C(=O)/C1=C/C2=CC=C(O2)C3=CC(=CC=C3)C(F)(F)F)C4=CC=C(C=C4)C(=O)O

Computed descriptors from PubChem (CID 98215399), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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