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Product details

名称

INO-1001

分子类型

小分子

英文别名

英文名称

INO-1001

货号

I651235-5mg

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

INO-1001 is a potent and selective poly (ADP-ribose) polymerase (PARP) inhibitor. INO-1001 is a potent enhancer of radiation sensitivity and enhances radiation-induced cell killing by interfering with DNA repair mechanisms, resulting in necrotic cell death INO-1001 has anti-tumor effects . In Vitro INO-1001 has an IC 50 of 0.05 μM in Chinese hamster ovary AA8 (CHO) cells. MCE has not independently confirmed the accuracy of these methods. They are for reference only. Form:Solid IC50& Target:PARP

生化机理

INO-1001 是一种强效的选择性聚（ADP-核糖）聚合酶（PARP）抑制剂。INO-1001 能有效增强辐射敏感性，并通过干扰 DNA 修复机制增强辐射诱导的细胞杀伤力，导致坏死细胞死亡。

CAS号

501364-82-5

分子式

C23H25N3O4S

分子量

439.5 g/mol

PubChem编号

9889396

Isomeric SMILES

C1COCCN1CCCNS(=O)(=O)C2=CC3=C(C=C2)C4=C(C3)C5=CC=CC=C5C(=O)N4

IIUPAC Name

N-(3-morpholin-4-ylpropyl)-5-oxo-6,11-dihydroindeno[1,2-c]isoquinoline-9-sulfonamide

INCHI

1S/C23H25N3O4S/c27-23-20-5-2-1-4-19(20)21-15-16-14-17(6-7-18(16)22(21)25-23)31(28,29)24-8-3-9-26-10-12-30-13-11-26/h1-2,4-7,14,24H,3,8-13,15H2,(H,25,27)

InChi Key

LTZVLHHIAUKGBP-UHFFFAOYSA-N

Smiles

C1COCCN1CCCNS(=O)(=O)C2=CC3=C(C=C2)C4=C(C3)C5=CC=CC=C5C(=O)N4

PubChem CID

9889396

溶解性

DMSO : 31.25 mg/mL (71.10 mM; Need ultrasonic)

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

439.157 Da

单同位素质量Monoisotopic Mass

439.157 Da

拓扑极表面积Topological Polar Surface Area

96.100 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

815.000

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

1.500

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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