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BI 2536CAS号 : 755038-02-9(DMSO)分子式: C28H39N7O3 分子量: 521.66SMILES: CCC1N(C2CCCC2)C3=NC(=NC=C3N(C)C1=O)NC4=CC=C(C=C4OC)C(=O)NC5CCN(C)CC5
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GSK461364CAS号 : 929095-18-1(DMSO)分子式: C27H28F3N5O2S 分子量: 543.6SMILES: CC(OC1=C(SC(=C1)[N]2C=NC3=C2C=C(CN4CCN(C)CC4)C=C3)C(N)=O)C5=CC=CC=C5C(F)(F)F
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Linagliptin (BI-1356)CAS号 : 668270-12-0(DMSO)分子式: C25H28N8O2 分子量: 472.54SMILES: CC#CC[N]1C(=NC2=C1C(=O)N(CC3=NC4=CC=CC=C4C(=N3)C)C(=O)N2C)N5CCCC(N)C5
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Adavosertib (MK-1775)CAS号 : 955365-80-7(DMSO)分子式: C27H32N8O2 分子量: 500.6SMILES: CN1CCN(CC1)C2=CC=C(NC3=NC4=C(C=N3)C(=O)N(CC=C)N4C5=NC(=CC=C5)C(C)(C)O)C=C2
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P276-00CAS号 : 920113-03-7(DMSO)分子式: C21H20ClNO5·HCl 分子量: 438.3SMILES: Cl.CN1CCC(C1CO)C2=C(O)C=C(O)C3=C2OC(=CC3=O)C4=C(Cl)C=CC=C4
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Saxagliptin (BMS-477118)CAS号 : 361442-04-8(DMSO)分子式: C18H25N3O2 分子量: 315.41SMILES: NC(C(=O)N1C(CC2CC12)C#N)[C]34CC5[CH2]C(C[C](O)(C5)C3)C4
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TAE684 (NVP-TAE684)CAS号 : 761439-42-3(DMSO)分子式: C30H40ClN7O3S 分子量: 614.2SMILES: COC1=C(NC2=NC=C(Cl)C(=N2)NC3=C(C=CC=C3)[S](=O)(=O)C(C)C)C=CC(=C1)N4CCC(CC4)N5CCN(C)CC5
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Vildagliptin (LAF-237)CAS号 : 274901-16-5(DMSO)分子式: C17H25N3O2 分子量: 303.4SMILES: O[C]12CC3[CH2]C(C1)C[C](C3)(C2)NCC(=O)N4CCCC4C#N
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Volasertib (BI 6727)CAS号 : 755038-65-4(DMSO)分子式: C34H50N8O3 分子量: 618.81SMILES: CCC1N(C(C)C)C2=C(C=NC(=N2)NC3=CC=C(C=C3OC)C(=O)NC4CCC(CC4)N5CCN(CC5)CC6CC6)N(C)C1=O
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阿糖腺苷CAS号 : 5536-17-4(DMSO)分子式: C10H13N5O4 分子量: 267.24SMILES: NC1=C2N=C[N](C3OC(CO)C(O)C3O)C2=NC=N1
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阿那格列汀CAS号 : 739366-20-2分子式: C19H25N7O2 分子量: 383.45IUPAC Name: N-[2-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]amino]-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxamideSMILES: CC1=NN2C=C(C=NC2=C1)C(=O)NCC(C)(C)NCC(=O)N3CCCC3C#NInChIKey: LDXYBEHACFJIEL-HNNXBMFYSA-NInChI: InChI=1S/C19H25N7O2/c1-13-7-16-21-9-14(11-26(16)24-13)18(28)22-12-19(2,3)23-10-17(27)25-6-4-5-15(25)8-20/h7,9,11,15,23H,4-6,10,12H2,1-3H3,(H,22,28)/t15-/m0/s1
