Molecular Formula | C18H17N5O3S |
Molar Mass | 383.42 |
Density | 1.42±0.1 g/cm3(Predicted) |
Boling Point | 673.7±65.0 °C(Predicted) |
Solubility | DMSO: 25.5 mg/mL |
pKa | 9.25±0.36(Predicted) |
Storage Condition | -20℃ |
In vitro study | MS436, through a set of water-mediated interactions, exhibits low nanomolar affinity (estimated K i of 30-50 nM) with preference for the first bromodomain over the second. MS436 effectively inhibits BRD4 activity in NF-κB-directed production of NO and pro-inflammatory cytokine interleukin-6 in murine macrophages. MS436 represents a new class of bromodomain inhibitors and will facilitate further investigation of the biological functions of the two bromodomains of BRD4 in gene expression. MS436 exhibits potent affinity of an estimated K i =30-50 nM for the BRD4 BrD1 and a 10-fold selectivity over the BrD2, which is achieved through a unique set of water-mediated intermolecular interactions. |
1mg | 5mg | 10mg | |
---|---|---|---|
1 mM | 2.608 ml | 13.04 ml | 26.081 ml |
5 mM | 0.522 ml | 2.608 ml | 5.216 ml |
10 mM | 0.261 ml | 1.304 ml | 2.608 ml |
5 mM | 0.052 ml | 0.261 ml | 0.522 ml |