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名称

DBPR108, 二肽基肽酶 IV 抑制剂

分子类型

小分子

英文别名

(2S,4S)-4-fluoro-1-(2-(2-methyl-4-oxo-4-(pyrrolidin-1-yl)butan-2-ylamino)acetyl)pyrrolidine-2-carbonitrile | (2S,4S)-4-fluoro-1-((2-methyl-4-oxo-4-(pyrrolidin-1-yl)butan-2-yl)glycyl)pyrrolidine-2-carbonitrile | PRUSOGLIPTIN [INN] | Prusogliptin | UNII-E32

英文名称

DBPR108

货号

D651610-5mg

包装规格

5mg

浓度

≥98%

储存温度

-20°C储存

运输条件

超低温冰袋运输

产品介绍

DBPR108 is a potent, selective, and orally bioavailable dipeptide-derived inhibitor of DPP4 with IC50 of 15 nM; no inhibition on DDP8 and DPP9.IC50 value: 15 nM Target: DPP4 inhibitorDBPR108 is an IC50=15 nM DPP IV inhibitor displays a more than 3000-fold selectivity over DPP8 DPP9, FAP and DPP-II. TThe in vivo effects of DBPR108, including inhibition of plasma DPP-IV activity and suppression of blood glucose elevation, were also demonstrated. DBPR108 is a potent, selective, long-acting and safe DPP-IV inhibitor as a potential treatment of type 2 diabetesmellitus. Form:Solid

生化机理

DBPR108 是一种强效、选择性和口服生物可用的二肽衍生型 DPP4 抑制剂，其 IC50 值为 15 nM；对 DDP8 和 DPP9 没有抑制作用：DBPR108是一种IC50=15 nM的DPP IV抑制剂，对DDP8和DPP9没有抑制作用。

CAS号

1186426-66-3

分子式

C16H25FN4O2

分子量

324.39 g/mol

PubChem编号

44201003

Isomeric SMILES

CC(C)(CC(=O)N1CCCC1)NCC(=O)N2C[C@H](C[C@H]2C#N)F

IIUPAC Name

(2S,4S)-4-fluoro-1-[2-[(2-methyl-4-oxo-4-pyrrolidin-1-ylbutan-2-yl)amino]acetyl]pyrrolidine-2-carbonitrile

INCHI

1S/C16H25FN4O2/c1-16(2,8-14(22)20-5-3-4-6-20)19-10-15(23)21-11-12(17)7-13(21)9-18/h12-13,19H,3-8,10-11H2,1-2H3/t12-,13-/m0/s1

InChi Key

VQKSCYBKUIDZEI-STQMWFEESA-N

Smiles

CC(C)(CC(=O)N1CCCC1)NCC(=O)N2CC(CC2C#N)F

PubChem CID

44201003

关联CAS

1186426-66-3

MeSH Entry Terms

(2S,4S)-4-fluoro-1-(2-((2-methyl-4-oxo-4-pyrrolidin-1-ylbutan-2-yl)amino)acetyl)pyrrolidine-2-carbonitrile;DBPR108

溶解性

DMSO : ≥ 25 mg/mL (77.07 mM)

氢键供体数Hydrogen Bond Donor Count

氢键受体数Hydrogen Bond Acceptor Count

可旋转键计数Rotatable Bond Count

精确质量Exact Mass

324.196 Da

单同位素质量Monoisotopic Mass

324.196 Da

拓扑极表面积Topological Polar Surface Area

76.400 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

507.000

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

0.200

ALogP

0.2

作用类型

抑制剂

作用机制

二肽基肽酶 IV 抑制剂

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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