F2276-0008
F2276-0008 is a potential PCAF bromodomain (PDB 5FDZ) inhibitor. F2276-0008 is predicted to have good cell permeability and oral absorption. F2276-0008 exhibits a stable C-alpha backbone RMSD and maintains compactness. F2276-0008 can be used for cancer-related research.
For research use only. We do not sell to patients.
- CAS No.: 922000-45-1
- Formula: C22H20N2O4
- Molecular Weight:376.41
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Storage:
Please store the product under the recommended conditions in the Certificate of Analysis.
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Biological Activity
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Chemical Information
- Protocols
- Purity & Documentation
- References
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Help & FAQs
Biological Activity
Description
In Vitro
F2276-0008 is a potential PCAF BRD inhibitor with an IFD score of -248.861[1].
F2276-0008 exhibits a highly favorable binding free energy (ΔGBind) of -93.853 kcal/mol with PCAF BRD[1].
F2276-0008 is predicted to have good drug-like properties, with 100% human oral absorption and good cell permeability[1].
F2276-0008 has HOMO, LUMO, and HLG values of -0.207, -0.049, and -0.158, respectively, indicating its chemical reactivity[1].
F2276-0008 forms a stable complex with PCAF BRD, with an RMSD of 1.2 Å[1].
F2276-0008 interacts with the PCAF BRD complex mainly through Asn803, Tyr809, and Tyr802[1].
MedChemExpress (MCE) has not independently confirmed the accuracy of these methods. They are for reference only. Further protocols information, click here.
Chemical Information
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CAS No. 922000-45-1
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Molecular Weight 376.41
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Formula C22H20N2O4
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SMILES
O=C(NC1=CC=C2OCCN(C(=O)C2=C1)C)COC=3C=CC=4C=CC=CC4C3
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Shipping
Room temperature in continental US; may vary elsewhere.
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Storage
Please store the product under the recommended conditions in the Certificate of Analysis.
Protocols
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Transepithelial/transendothelial electrical resistance assay
TEER measures electrical resistance across epithelial or endothelial monolayers cultured on permeable supports, and the readout reflects ionic conductance through the cell barrier, especially the paracellular pathway regulated by junctional integrity. TEER can be measured without destroying the monolayer and is commonly used before or during transport, permeability, barrier-disruption, and barrier-maturation experiments. TEER values are influenced by biological maturation and technical conditions; reported factors include temperature, medium formulation, passage number, electrode geometry, membrane properties, and junctional length during early monolayer maturation. Therefore, TEER should be interpreted with blank-insert subtraction, area normalization, repeated readings, and, when possible, orthogonal barrier readouts such as FITC-dextran flux or tight-junction staining.
Purity & Documentation
References
Calculators
Concentration (start) × Volume (start) = Concentration (final) × Volume (final)
F2276-0008 Related Classifications
HY-153147 Related Classifications
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