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1-萘基PP1CAS号 : 221243-82-9分子式: C19H19N5 分子量: 317.39IUPAC Name: 1-tert-butyl-3-naphthalen-1-ylpyrazolo[3,4-d]pyrimidin-4-amineSMILES: CC(C)(C)N1C2=NC=NC(=C2C(=N1)C3=CC=CC4=CC=CC=C43)NInChIKey: XSHQBIXMLULFEV-UHFFFAOYSA-NInChI: InChI=1S/C19H19N5/c1-19(2,3)24-18-15(17(20)21-11-22-18)16(23-24)14-10-6-8-12-7-4-5-9-13(12)14/h4-11H,1-3H3,(H2,20,21,22)
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SU 9516,cyclin依赖性激酶（cdk）抑制剂CAS号 : 377090-84-1 Compound CID : 5289419分子式: C13H11N3O2 分子量: 241.25IUPAC Name: (3Z)-3-(1H-imidazol-5-ylmethylidene)-5-methoxy-1H-indol-2-oneSMILES: COC1=CC2=C(C=C1)NC(=O)C2=CC3=CN=CN3InChIKey: QNUKRWAIZMBVCU-WCIBSUBMSA-NInChI: InChI=1S/C13H11N3O2/c1-18-9-2-3-12-10(5-9)11(13(17)16-12)4-8-6-14-7-15-8/h2-7H,1H3,(H,14,15)(H,16,17)/b11-4-
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CGP 54626 盐酸盐CAS号 : 149184-21-4 Compound CID : 197583分子式: C18H28Cl2NO3P•HCl 分子量: 444.76IUPAC Name: cyclohexylmethyl-[(2S)-3-[[(1S)-1-(3,4-dichlorophenyl)ethyl]amino]-2-hydroxypropyl]phosphinic acid;hydrochlorideSMILES: CC(C1=CC(=C(C=C1)Cl)Cl)NCC(CP(=O)(CC2CCCCC2)O)O.ClInChIKey: ZQCFHOVIXCJPLE-LINSIKMZSA-NInChI: InChI=1S/C18H28Cl2NO3P.ClH/c1-13(15-7-8-17(19)18(20)9-15)21-10-16(22)12-25(23,24)11-14-5-3-2-4-6-14;/h7-9,13-14,16,21-22H,2-6,10-12H2,1H3,(H,23,24);1H/t13-,16-;/m0./s1
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Cdk2 / 9抑制剂CAS号 : 507487-89-0 Compound CID : 447961分子式: C14H12N6O2S 分子量: 328.35IUPAC Name: 4-methyl-5-[2-(3-nitroanilino)pyrimidin-4-yl]-1,3-thiazol-2-amineSMILES: CC1=C(SC(=N1)N)C2=NC(=NC=C2)NC3=CC(=CC=C3)[N+](=O)[O-]InChIKey: DYTKVFHLKPDNRW-UHFFFAOYSA-NInChI: InChI=1S/C14H12N6O2S/c1-8-12(23-13(15)17-8)11-5-6-16-14(19-11)18-9-3-2-4-10(7-9)20(21)22/h2-7H,1H3,(H2,15,17)(H,16,18,19)
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AT7519CAS号 : 844442-38-2(DMSO)分子式: C16H17Cl2N5O2 分子量: 382.24SMILES: ClC1=CC=CC(=C1C(=O)NC2=C[NH]N=C2C(=O)NC3CCNCC3)Cl
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AZD5438CAS号 : 602306-29-6(DMSO)分子式: C18H21N5O2S 分子量: 371.46SMILES: CC(C)[N]1C(=NC=C1C2=NC(=NC=C2)NC3=CC=C(C=C3)[S](C)(=O)=O)C
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BMS-265246CAS号 : 582315-72-8(DMSO)分子式: C18H17F2N3O2 分子量: 345.34SMILES: CCCCOC1=C2C=N[NH]C2=NC=C1C(=O)C3=C(F)C=C(C)C=C3F
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BX-795CAS号 : 702675-74-9(DMSO)分子式: C23H26IN7O2S 分子量: 591.47SMILES: IC1=CN=C(NC2=CC(=CC=C2)NC(=O)N3CCCC3)N=C1NCCCNC(=O)C4=CC=CS4
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BX-912CAS号 : 702674-56-4(DMSO)分子式: C20H23BrN8O 分子量: 471.35SMILES: BrC1=CN=C(NC2=CC(=CC=C2)NC(=O)N3CCCC3)N=C1NCCC4=CN=C[NH]4
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Dabrafenib (GSK2118436)CAS号 : 1195765-45-7(DMSO)分子式: C23H20F3N5O2S2 分子量: 519.56SMILES: CC(C)(C)C1=NC(=C(S1)C2=NC(=NC=C2)N)C3=C(F)C(=CC=C3)N[S](=O)(=O)C4=C(F)C=CC=C4F
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Dinaciclib (SCH727965)CAS号 : 779353-01-4(DMSO)分子式: C21H28N6O2 分子量: 396.49SMILES: CCC1=C2N=C(C=C(NCC3=CC=C[N+](=C3)[O-])[N]2N=C1)N4CCCCC4CCO
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JNJ-7706621CAS号 : 443797-96-4(DMSO)分子式: C15H12F2N6O3S 分子量: 394.36SMILES: NC1=NC(=N[N]1C(=O)C2=C(F)C=CC=C2F)NC3=CC=C(C=C3)[S](N)(=O)=O
