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Chemical structure of Varespladib Methyl

GC31825

Varespladib Methyl

Also listed as Varespladib methyl (A-002)

Varespladib methyl (A-002) (A-002; LY333013) is a selective inhibitor of group II secretory phospholipase A2 (PLA2)

ChemicalCAS172733-08-3MW394.42FormulaC22H22N2O5
CAS number
172733-08-3
Molecular weight
394.42
Formula
C22H22N2O5
Solubility
DMSO: 100 mg/mL (253·54 mM)
InChIKey
VJYDOJXJUCJUHL-UHFFFAOYSA-N
Catalogue number
GC31825
Brand
GLPBIO
Computed properties PubChem CID 9886917 · XLogP 3.1 · TPSA 101 Ų · H-bond donors 1
XLogP
3.1
TPSA
101 Ų
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
29

SMILES CCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC=C2OCC(=O)OC)C(=O)C(=O)N

Computed descriptors from PubChem (CID 9886917), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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