小分子和化合物库

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显示第112个,产品总数58

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  1. UPF 1069,PARP2抑制剂
      规格或纯度 :
    • ≥98%
    CAS号 : 1048371-03-4        Compound CID : 25015515
    分子式: C17H13NO3        分子量: 279.29
    IUPAC Name: 5-phenacyloxy-2H-isoquinolin-1-one
    SMILES: C1=CC=C(C=C1)C(=O)COC2=CC=CC3=C2C=CNC3=O
    InChIKey: JJWMRRNGWSITSQ-UHFFFAOYSA-N
    InChI: InChI=1S/C17H13NO3/c19-15(12-5-2-1-3-6-12)11-21-16-8-4-7-14-13(16)9-10-18-17(14)20/h1-10H,11H2,(H,18,20)
  2. AZ9482
      规格或纯度 :
    • ≥98%
    CAS号 : 1825345-33-2        Compound CID : 92045137
    分子式: C26H22N6O2        分子量: 450.5
    IUPAC Name: 2-[4-[3-[(4-oxo-3H-phthalazin-1-yl)methyl]benzoyl]piperazin-1-yl]pyridine-3-carbonitrile
    SMILES: C1CN(CCN1C2=C(C=CC=N2)C#N)C(=O)C3=CC=CC(=C3)CC4=NNC(=O)C5=CC=CC=C54
    InChIKey: ZDDPBFWHZOJFHF-UHFFFAOYSA-N
    InChI: InChI=1S/C26H22N6O2/c27-17-20-7-4-10-28-24(20)31-11-13-32(14-12-31)26(34)19-6-3-5-18(15-19)16-23-21-8-1-2-9-22(21)25(33)30-29-23/h1-10,15H,11-14,16H2,(H,30,33)
  3. E7449
      规格或纯度 :
    • ≥97%
    CAS号 : 1140964-99-3        Compound CID : 135565981
    分子式: C18H15N5O        分子量: 317.34
    IUPAC Name: 11-(1,3-dihydroisoindol-2-ylmethyl)-2,3,10,12-tetrazatricyclo[7.3.1.05,13]trideca-1,5(13),6,8,11-pentaen-4-one
    SMILES: C1C2=CC=CC=C2CN1CC3=NC4=NNC(=O)C5=C4C(=CC=C5)N3
    InChIKey: JLFSBHQQXIAQEC-UHFFFAOYSA-N
    InChI: InChI=1S/C18H15N5O/c24-18-13-6-3-7-14-16(13)17(21-22-18)20-15(19-14)10-23-8-11-4-1-2-5-12(11)9-23/h1-7H,8-10H2,(H,22,24)(H,19,20,21)
  4. AZ 6102
    CAS号 : 1645286-75-4        Compound CID : 135905416
    分子式: C25H28N6O        分子量: 428.53
    IUPAC Name: 2-[4-[6-[(3R,5S)-3,5-dimethylpiperazin-1-yl]-4-methylpyridin-3-yl]phenyl]-7-methyl-3H-pyrrolo[2,3-d]pyrimidin-4-one
    SMILES: CC1CN(CC(N1)C)C2=NC=C(C(=C2)C)C3=CC=C(C=C3)C4=NC5=C(C=CN5C)C(=O)N4
    InChIKey: WCPTUQOMNJBIET-CALCHBBNSA-N
    InChI: InChI=1S/C25H28N6O/c1-15-11-22(31-13-16(2)27-17(3)14-31)26-12-21(15)18-5-7-19(8-6-18)23-28-24-20(25(32)29-23)9-10-30(24)4/h5-12,16-17,27H,13-14H2,1-4H3,(H,28,29,32)/t16-,17+
  5. E7449
      规格或纯度 :
    • 10mM in DMSO
    CAS号 : 1140964-99-3        Compound CID : 135565981
    分子式: C18H15N5O        分子量: 317.34
    IUPAC Name: 11-(1,3-dihydroisoindol-2-ylmethyl)-2,3,10,12-tetrazatricyclo[7.3.1.05,13]trideca-1,5(13),6,8,11-pentaen-4-one
    SMILES: C1C2=CC=CC=C2CN1CC3=NC4=NNC(=O)C5=C4C(=CC=C5)N3
    InChIKey: JLFSBHQQXIAQEC-UHFFFAOYSA-N
    InChI: InChI=1S/C18H15N5O/c24-18-13-6-3-7-14-16(13)17(21-22-18)20-15(19-14)10-23-8-11-4-1-2-5-12(11)9-23/h1-7H,8-10H2,(H,22,24)(H,19,20,21)
  6. WAY-659977
      规格或纯度 :
    • 10mM in DMSO
    CAS号 : 869474-43-1        Compound CID : 135566794
    分子式: C25H22N4O4        分子量: 442.47
    IUPAC Name: N-(2-methoxyphenyl)-4-[3-(4-oxo-3H-quinazolin-2-yl)propanoylamino]benzamide
    SMILES: COC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC(=O)CCC3=NC4=CC=CC=C4C(=O)N3
    InChIKey: WWKKOAKRYQQEBT-UHFFFAOYSA-N
    InChI: InChI=1S/C25H22N4O4/c1-33-21-9-5-4-8-20(21)28-24(31)16-10-12-17(13-11-16)26-23(30)15-14-22-27-19-7-3-2-6-18(19)25(32)29-22/h2-13H,14-15H2,1H3,(H,26,30)(H,28,31)(H,27,29,32)
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