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经验公式(希尔记法):
C31H33N5O4
化学文摘社编号:
分子量:
539.62
UNSPSC Code:
12352200
NACRES:
NA.77
MDL number:
产品名称
尼达尼布, ≥98% (HPLC)
InChI
1S/C31H33N5O4/c1-34-15-17-36(18-16-34)20-27(37)35(2)24-12-10-23(11-13-24)32-29(21-7-5-4-6-8-21)28-25-14-9-22(31(39)40-3)19-26(25)33-30(28)38/h4-14,19,32H,15-18,20H2,1-3H3,(H,33,38)/b29-28-
InChI key
XZXHXSATPCNXJR-ZIADKAODSA-N
SMILES string
O=C(NC1=C2)/C(C1=CC=C2C(OC)=O)=C(C3=CC=CC=C3)\NC4=CC=C(C=C4)N(C(CN5CCN(CC5)C)=O)C
assay
≥98% (HPLC)
form
powder
color
white to beige
solubility
DMSO: 2 mg/mL, clear
storage temp.
2-8°C
Quality Level
Biochem/physiol Actions
口服活性,强效ATP竞争性VEGFR,FGFR,PDGFR,Flt3,Lck,Lyn,Src抑制剂,具有体内抗血管生成和抗纤维化功效。
尼达尼布(BIBF1120)是一种口服活性、强效ATP竞争性抑制剂,可抑制血管激酶VEGFR-1/2/3(IC50 = 34/21/13 nM)、FGFR-1/2/3/4(IC50 = 69/37/108/610 nM)、PDGFRα/β(IC50 = 59/65 nM)以及Flt-3、Lck、Lyn和Src(分别为IC50 = 26、16、195、156 nM),但不抑制33种其他激酶。尼达尼布在体内癌症和肺纤维化的培养物和动物模型中表现出抗血管生成和抗纤维化疗效。
signalword
Danger
Hazard Classifications
Acute Tox. 3 Oral - Eye Dam. 1 - Repr. 2 - Skin Irrit. 2 - STOT RE 1
存储类别
6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
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