小分子和化合物库

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显示第4960个,产品总数268

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  1. (±)-PPCC草酸盐
      规格或纯度 :
    • ≥99%(HPLC)
    CAS号: 932736-91-9        Compound CID : 90488889
    分子式: C₂₄H₂₉NO₃•C₂H₂O₄        分子量: 469.53
    IUPAC Name: methyl (1S,2R)-2-[(4-hydroxy-4-phenylpiperidin-1-yl)methyl]-1-(4-methylphenyl)cyclopropane-1-carboxylate;methyl (1R,2S)-2-[(4-hydroxy-4-phenylpiperidin-1-yl)methyl]-1-(4-methylphenyl)cyclopropane-1-caSee more
    SMILES: CC1=CC=C(C=C1)C2(CC2CN3CCC(CC3)(C4=CC=CC=C4)O)C(=O)OC.CC1=CC=C(C=C1)C2(CC2CN3CCC(CC3)(C4=CC=CC=C4)O)C(=O)OC.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O
    InChIKey: IGJDSEGFEVKASG-KLELIYFTSA-N
    InChI: 1S/2C24H29NO3.2C2H2O4/c2*1-18-8-10-20(11-9-18)24(22(26)28-2)16-21(24)17-25-14-12-23(27,13-15-25)19-6-4-3-5-7-19;2*3-1(4)2(5)6/h2*3-11,21,27H,12-17H2,1-2H3;2*(H,3,4)(H,5,6)/t2*21-,24+;;/m10../s1
  2. PNU 177864 盐酸盐
      规格或纯度 :
    • ≥99%(HPLC)
    CAS号: 1783978-03-9        Compound CID : 56972219
    分子式: C18H22ClF3N2O3S        分子量: 438.89
    IUPAC Name: N-[4-[2-(propylamino)ethyl]phenyl]-4-(trifluoromethoxy)benzenesulfonamide;hydrochloride
    SMILES: CCCNCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)OC(F)(F)F.Cl
    InChIKey: UOMDLHQTLPWCCE-UHFFFAOYSA-N
    InChI: 1S/C18H21F3N2O3S.ClH/c1-2-12-22-13-11-14-3-5-15(6-4-14)23-27(24,25)17-9-7-16(8-10-17)26-18(19,20)21;/h3-10,22-23H,2,11-13H2,1H3;1H
  3. Phenamil,抑制TRPP3介导的电流
      规格或纯度 :
    • ≥99%(HPLC)
    CAS号: 1161-94-0        Compound CID : 135419184
    分子式: C12H12ClN7O·CH3SO3H        分子量: 401.83
    IUPAC Name: 3,5-diamino-6-chloro-N-(N'-phenylcarbamimidoyl)pyrazine-2-carboxamide;methanesulfonic acid
    SMILES: CS(=O)(=O)O.C1=CC=C(C=C1)N=C(N)NC(=O)C2=C(N=C(C(=N2)Cl)N)N
    InChIKey: MHPIZTURFVSLTJ-UHFFFAOYSA-N
    InChI: 1S/C12H12ClN7O.CH4O3S/c13-8-10(15)19-9(14)7(18-8)11(21)20-12(16)17-6-4-2-1-3-5-6;1-5(2,3)4/h1-5H,(H4,14,15,19)(H3,16,17,20,21);1H3,(H,2,3,4)
  4. PHA 568487,α7nAChR激动剂
      规格或纯度 :
    • ≥99%(HPLC)
    CAS号: 527680-57-5        Compound CID : 56972212
    分子式: C16H20N2O3.C4H4O4        分子量: 404.41
    IUPAC Name: N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide;(E)-but-2-enedioic acid
    SMILES: C1CN2CCC1C(C2)NC(=O)C3=CC4=C(C=C3)OCCO4.C(=CC(=O)O)C(=O)O
    InChIKey: QYQZUGYJVHHHEE-QDSMGTAFSA-N
    InChI: 1S/C16H20N2O3.C4H4O4/c19-16(17-13-10-18-5-3-11(13)4-6-18)12-1-2-14-15(9-12)21-8-7-20-14;5-3(6)1-2-4(7)8/h1-2,9,11,13H,3-8,10H2,(H,17,19);1-2H,(H,5,6)(H,7,8)/b;2-1+/t13-;/m0./s1
  5. PCI 29732,BTK抑制剂
      规格或纯度 :
    • ≥99%(HPLC)
    CAS号: 330786-25-9        Compound CID : 22347110
    分子式: C22H21N5O        分子量: 371.44
    IUPAC Name: 1-cyclopentyl-3-(4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine
    SMILES: C1CCC(C1)N2C3=NC=NC(=C3C(=N2)C4=CC=C(C=C4)OC5=CC=CC=C5)N
    InChIKey: GMJUPMONHWAZCP-UHFFFAOYSA-N
    InChI: 1S/C22H21N5O/c23-21-19-20(26-27(16-6-4-5-7-16)22(19)25-14-24-21)15-10-12-18(13-11-15)28-17-8-2-1-3-9-17/h1-3,8-14,16H,4-7H2,(H2,23,24,25)
  6. Org 25543 盐酸盐
      规格或纯度 :
    • ≥99%(HPLC)
    CAS号: 495076-64-7
    分子式: C₂₄H₃₂lN₂O₄.HCl        分子量: 448.98
    IUPAC Name: N-[[1-(dimethylamino)cyclopentyl]methyl]-3,5-dimethoxy-4-phenylmethoxybenzamide;hydrochloride
    SMILES: CN(C)C1(CCCC1)CNC(=O)C2=CC(=C(C(=C2)OC)OCC3=CC=CC=C3)OC.Cl
    InChIKey: NIPQJILJYQVZJR-UHFFFAOYSA-N
    InChI: 1S/C24H32N2O4.ClH/c1-26(2)24(12-8-9-13-24)17-25-23(27)19-14-20(28-3)22(21(15-19)29-4)30-16-18-10-6-5-7-11-18;/h5-7,10-11,14-15H,8-9,12-13,16-17H2,1-4H3,(H,25,27);1H
  7. NS 5806,KV4.3通道激活器
      规格或纯度 :
    • ≥99%(HPLC)
    CAS号: 426834-69-7
    分子式: C16H8Br2F6N6O        分子量: 574.07
    IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[2,4-dibromo-6-(2H-tetrazol-5-yl)phenyl]urea
    SMILES: C1=C(C=C(C=C1C(F)(F)F)NC(=O)NC2=C(C=C(C=C2Br)Br)C3=NNN=N3)C(F)(F)F
    InChIKey: UZWJWROOLOOCPQ-UHFFFAOYSA-N
    InChI: 1S/C16H8Br2F6N6O/c17-8-4-10(13-27-29-30-28-13)12(11(18)5-8)26-14(31)25-9-2-6(15(19,20)21)1-7(3-9)16(22,23)24/h1-5H,(H2,25,26,31)(H,27,28,29,30)
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