(2S)-1-[(2S)-3,3-dimethyl-2-[(2S)-2-(methylamino)propanamido]butanoyl]-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrrolidine-2-carboxamide

• 常用名: (2S)-1-[(2S)-3,3-dimethyl-2-[(2S)-2-(methylamino)propanamido]butanoyl]-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrrolidine-2-carboxamide
• 英文名: (2S)-1-[(2S)-3,3-dimethyl-2-[(2S)-2-(methylamino)propanamido]butanoyl]-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrrolidine-2-carboxamide
• CAS号: 846550-96-7
• 分子量: 442.6
• 密度: N/A
• 沸点: N/A
• 分子式: C₂₅H₃₈N₄O₃
• 熔点: N/A
• 闪点: N/A

名称

• 英文名: (2S)-1-[(2S)-3,3-dimethyl-2-[(2S)-2-(methylamino)propanamido]butanoyl]-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrrolidine-2-carboxamide

物理化学性质

• 分子式: C₂₅H₃₈N₄O₃
• 分子量: 442.6
• InChIKey: JUJIMRZGUBTJRV-LRGNLBRXSA-N
• SMILES: CNC(C)C(=O)NC(C(=O)N1CCCC1C(=O)NC1CCCc2ccccc21)C(C)(C)C

靶点实验

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实验名称：Binding affinity to the BIR3 domain of X-linked IAP 来源：ChEMBL 靶标：E3 ubiquitin-protein ligase XIAP External Id：CHEMBL826995

实验名称：The compound was tested for toxicity against human melanoma cancer cell line SK-MEL-5... 来源：ChEMBL 靶标：SK-MEL-5 External Id：CHEMBL834368

实验名称：The compound was tested for toxicity against human NSCL cancer cell line NCI-H522; NA... 来源：ChEMBL 靶标：NON-PROTEIN TARGET External Id：CHEMBL832475

实验名称：The compound was tested for toxicity against human breast cancer cell line MDA-MB-231 来源：ChEMBL 靶标：NON-PROTEIN TARGET External Id：CHEMBL833832

实验名称：Binding affinity to XIAP-BIR3 domain (241 to 356 residues) (unknown origin) by fluore... 来源：ChEMBL 靶标：E3 ubiquitin-protein ligase XIAP External Id：CHEMBL4351153

实验名称：The compound was tested for toxicity against human renal cancer cell line RXF-393; NA... 来源：ChEMBL 靶标：NON-PROTEIN TARGET External Id：CHEMBL832477

实验名称：The compound was tested for toxicity against human breast cancer cell line BT-549; NA... 来源：ChEMBL 靶标：BT-549 External Id：CHEMBL832476

实验名称：The compound was tested for toxicity against human NSCL cancer cell line NCI-H23; NA=... 来源：ChEMBL 靶标：NON-PROTEIN TARGET External Id：CHEMBL833289

实验名称：Ligand Binding Assay from Article 10.1021/jm040037k: "Discovery of potent antagonists... 来源：BindingDB 靶标：N/A External Id：BindingDB_1670_1

实验名称：The compound was tested for toxicity against human leukemia cancer cell line HL-60; N... 来源：ChEMBL 靶标：HL-60 External Id：CHEMBL840823

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