小分子和化合物库

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  1. PHA-793887
      规格或纯度 :
    • ≥95%
    CAS号 : 718630-59-2        Compound CID : 46191454
    分子式: C19H31N5O2        分子量: 361.48
    IUPAC Name: N-[6,6-dimethyl-5-(1-methylpiperidine-4-carbonyl)-1,4-dihydropyrrolo[3,4-c]pyrazol-3-yl]-3-methylbutanamide
    SMILES: CC(C)CC(=O)NC1=NNC2=C1CN(C2(C)C)C(=O)C3CCN(CC3)C
    InChIKey: HUXYBQXJVXOMKX-UHFFFAOYSA-N
    InChI: InChI=1S/C19H31N5O2/c1-12(2)10-15(25)20-17-14-11-24(19(3,4)16(14)21-22-17)18(26)13-6-8-23(5)9-7-13/h12-13H,6-11H2,1-5H3,(H2,20,21,22,25)
  2. SU 9516,cyclin依赖性激酶(cdk)抑制剂
      规格或纯度 :
    • ≥98%
    CAS号 : 377090-84-1        Compound CID : 5289419
    分子式: C13H11N3O2        分子量: 241.25
    IUPAC Name: (3Z)-3-(1H-imidazol-5-ylmethylidene)-5-methoxy-1H-indol-2-one
    SMILES: COC1=CC2=C(C=C1)NC(=O)C2=CC3=CN=CN3
    InChIKey: QNUKRWAIZMBVCU-WCIBSUBMSA-N
    InChI: 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-
  3. THZ2
      规格或纯度 :
    • ≥98%
    CAS号 : 1604810-84-5        Compound CID : 78357763
    分子式: C31H28ClN7O2        分子量: 566.05
    IUPAC Name: N-[3-[[5-chloro-4-(1H-indol-3-yl)pyrimidin-2-yl]amino]phenyl]-3-[[(E)-4-(dimethylamino)but-2-enoyl]amino]benzamide
    SMILES: CN(C)CC=CC(=O)NC1=CC=CC(=C1)C(=O)NC2=CC=CC(=C2)NC3=NC=C(C(=N3)C4=CNC5=CC=CC=C54)Cl
    InChIKey: FONRCZUZCHXWBD-VGOFMYFVSA-N
    InChI: InChI=1S/C31H28ClN7O2/c1-39(2)15-7-14-28(40)35-21-9-5-8-20(16-21)30(41)36-22-10-6-11-23(17-22)37-31-34-19-26(32)29(38-31)25-18-33-27-13-4-3-12-24(25)27/h3-14,16-19,33H,15H2,1-2H3,(H,35,40)(H,36,41)(H,34,37,38)/b14-7+
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