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  1. 依鲁替尼 (PCI-32765)
    CAS号 : 936563-96-1        Compound CID : 24821094
    分子式: C25H24N6O2        分子量: 440.5
    IUPAC Name: 1-[(3R)-3-[4-amino-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]piperidin-1-yl]prop-2-en-1-one
    SMILES: C=CC(=O)N1CCCC(C1)N2C3=NC=NC(=C3C(=N2)C4=CC=C(C=C4)OC5=CC=CC=C5)N
    InChIKey: XYFPWWZEPKGCCK-GOSISDBHSA-N
    InChI: InChI=1S/C25H24N6O2/c1-2-21(32)30-14-6-7-18(15-30)31-25-22(24(26)27-16-28-25)23(29-31)17-10-12-20(13-11-17)33-19-8-4-3-5-9-19/h2-5,8-13,16,18H,1,6-7,14-15H2,(H2,26,27,28)/t18-/m1/s1
  2. TRAM-34,K Ca 3.1通道阻滞剂
    CAS号 : 289905-88-0        Compound CID : 656734
    分子式: C22H17ClN2        分子量: 344.84
    IUPAC Name: 1-[(2-chlorophenyl)-diphenylmethyl]pyrazole
    SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3Cl)N4C=CC=N4
    InChIKey: KBFUQFVFYYBHBT-UHFFFAOYSA-N
    InChI: InChI=1S/C22H17ClN2/c23-21-15-8-7-14-20(21)22(25-17-9-16-24-25,18-10-3-1-4-11-18)19-12-5-2-6-13-19/h1-17H
  3. AN-2728,PDE4和cytokine释放抑制剂
    CAS号 : 906673-24-3        Compound CID : 44591583
    分子式: C14H10BNO3        分子量: 251.05
    IUPAC Name: 4-[(1-hydroxy-3H-2,1-benzoxaborol-5-yl)oxy]benzonitrile
    SMILES: B1(C2=C(CO1)C=C(C=C2)OC3=CC=C(C=C3)C#N)O
    InChIKey: USZAGAREISWJDP-UHFFFAOYSA-N
    InChI: InChI=1S/C14H10BNO3/c16-8-10-1-3-12(4-2-10)19-13-5-6-14-11(7-13)9-18-15(14)17/h1-7,17H,9H2
  4. NS 6180,KCa3.1(IK)通道阻止器
    CAS号 : 353262-04-1        Compound CID : 11837221
    分子式: C16H12F3NOS        分子量: 323.33
    IUPAC Name: 4-[[3-(trifluoromethyl)phenyl]methyl]-1,4-benzothiazin-3-one
    SMILES: C1C(=O)N(C2=CC=CC=C2S1)CC3=CC(=CC=C3)C(F)(F)F
    InChIKey: ZUIJXKLTUFCDGO-UHFFFAOYSA-N
    InChI: InChI=1S/C16H12F3NOS/c17-16(18,19)12-5-3-4-11(8-12)9-20-13-6-1-2-7-14(13)22-10-15(20)21/h1-8H,9-10H2
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