GSK3145095, 受体相互作用丝氨酸/苏氨酸激酶 1 抑制剂

RIP 激酶抑制剂

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货号 (SKU)	包装规格	是否现货	价格	数量
G421970-1ml	1ml	现货

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Compound libraries (12332) Extrinsic Pathway (690)

基本描述

英文别名	BCP31015 \| 5-benzyl-N-[(3S)-7,9-difluoro-2-oxo-1,3,4,5-tetrahydro-1-benzazepin-3-yl]-1H-1,2,4-triazole-3-carboxamide \| EX-A3069 \| (S)-5-Benzyl-N-(7,9-difluoro-2-oxo-2,3,4,5-tetrahydro-1hbenzo(b)azepin-3-yl)-1H-1,2,4-triazole-3-carboxamide (7,7-dimethyl-2-
规格或纯度	Moligand™, 10mM in DMSO
英文名称	GSK3145095
生化机理	GSK3145095 是一种强效的口服活性 RIP1 激酶抑制剂，其 IC50 值为 6.3 nM，具有潜在的抗肿瘤和免疫调节活性。
储存温度	-80℃储存
运输条件	超低温冰袋运输
作用类型	抑制剂
作用机制	受体相互作用丝氨酸/苏氨酸激酶 1 抑制剂
产品介绍	Information GSK3145095 GSK3145095 is a potent and orally active RIP1 kinase inhibitor with IC50 of 6.3 nM with potential antineoplastic and immunomodulatory activities. Targets RIP1 kinase (Cell-free assay) 6.3 nM In vitro GSK3145095 potently binds to RIP1 with exquisite kinase specificity and has excellent activity in blocking RIP1 kinasedependent cellular responses. Highlighting its potential as a novel cancer therapy, the inhibitor is also able to promote a tumor suppressive T cell phenotype in pancreatic adenocarcinoma organ cultures. Cell Research(from reference) Cell lines：U937 cells, L-cells NCTC 929 (L929) cells Concentrations：0-3 μM Incubation Time：5 h

RIPK1 Tchem 受体相互作用丝氨酸/苏氨酸蛋白激酶 1(Receptor-interacting serine/threonine-protein kinase 1) (8 活性数据)

点击查看靶蛋白信息： RIPK1

活性类型	活性值-log(M)	作用机制	期刊	参考文献(PubMed IDs)

作用机制	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	参考文献

分子类型	未知
IUPAC Name	5-benzyl-N-[(3S)-7,9-difluoro-2-oxo-1,3,4,5-tetrahydro-1-benzazepin-3-yl]-1H-1,2,4-triazole-3-carboxamide
INCHI	InChI=1S/C20H17F2N5O2/c21-13-9-12-6-7-15(19(28)25-17(12)14(22)10-13)23-20(29)18-24-16(26-27-18)8-11-4-2-1-3-5-11/h1-5,9-10,15H,6-8H2,(H,23,29)(H,25,28)(H,24,26,27)/t15-/m0/s1
InChi Key	ATQAGKAMBISZQM-HNNXBMFYSA-N
Canonical SMILES	C1CC2=C(C(=CC(=C2)F)F)NC(=O)C1NC(=O)C3=NNC(=N3)CC4=CC=CC=C4
Isomeric SMILES	C1CC2=C(C(=CC(=C2)F)F)NC(=O)[C@H]1NC(=O)C3=NNC(=N3)CC4=CC=CC=C4
分子量	397.38
Reaxy-Rn	60346311
Reaxys-RN link address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=60346311&ln=

DMSO(mg / mL) Max Solubility	79
DMSO(mM) Max Solubility	198.802154109417
Water(mg / mL) Max Solubility	＜1
分子量	397.400 g/mol
XLogP3	3.100
氢键供体数Hydrogen Bond Donor Count	3
氢键受体数Hydrogen Bond Acceptor Count	6
可旋转键计数Rotatable Bond Count	4
精确质量Exact Mass	397.135 Da
单同位素质量Monoisotopic Mass	397.135 Da
拓扑极表面积Topological Polar Surface Area	99.800 Å²
重原子数Heavy Atom Count	29
形式电荷Formal Charge	0
复杂度Complexity	603.000
同位素原子数Isotope Atom Count	0
定义的原子立体中心计数Defined Atom Stereocenter Count	1
未定义的原子立体中心计数Undefined Atom Stereocenter Count	0
定义的键立体中心计数Defined Bond Stereocenter Count	0
未定义的键立体中心计数Undefined Bond Stereocenter Count	0
所有立体化学键的总数The total count of all stereochemical bonds	0
共价键合单元计数Covalently-Bonded Unit Count	1