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Chemical structure of CD80-IN-3

GC60102

CD80-IN-3

Also known as 4-(6-fluoro-3-oxo-1H-pyrazolo[4,3-c]quinolin-2-yl)benzoic acid

CD80-IN-3, a potent CD80 inhibitor, inhibits CD80/CD28 interaction with an EC50 of 630 nM and a Kd of 125 nM

ChemicalCAS486449-65-4MW323.28FormulaC17H10FN3O3
CAS number
486449-65-4
Molecular weight
323.28
Formula
C17H10FN3O3
Solubility
DMSO： 35·71 mg/mL (110·46 mM)
InChIKey
NLGJRBLPUVEYKC-UHFFFAOYSA-N
Catalogue number
GC60102
Brand
GLPBIO
Computed properties PubChem CID 644103 · XLogP 2.8 · TPSA 82.5 Ų · H-bond donors 2
XLogP
2.8
TPSA
82.5 Ų
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
24

SMILES C1=CC2=C3C(=CN=C2C(=C1)F)C(=O)N(N3)C4=CC=C(C=C4)C(=O)O

Computed descriptors from PubChem (CID 644103), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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