按“信号通路”分类 - 小分子和化合物库

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二苯基硼酸-2-氨基乙酯
- ≥98%
CAS号: 524-95-8 EC号: 208-366-5

分子式: C₁₄H₁₆BNO 分子量: 225.09

IUPAC Name: 2-diphenylboranyloxyethanamine

SMILES: B(C1=CC=CC=C1)(C2=CC=CC=C2)OCCN

InChIKey: BLZVCIGGICSWIG-UHFFFAOYSA-N

InChI: 1S/C14H16BNO/c16-11-12-17-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10H,11-12,16H2
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胃蛋白酶抑制剂
- ≥75%(HPLC)
CAS号: 26305-03-3

分子式: C₃₄H₆₃N₅O₉ 分子量: 685.89

IUPAC Name: (3S,4S)-3-hydroxy-4-[[(2S)-2-[[(3S,4S)-3-hydroxy-6-methyl-4-[[(2S)-3-methyl-2-[[(2S)-3-methyl-2-(3-methylbutanoylamino)butanoyl]amino]butanoyl]amino]heptanoyl]amino]propanoyl]amino]-6-methylheptanoic See more

SMILES: CC(C)CC(C(CC(=O)O)O)NC(=O)C(C)NC(=O)CC(C(CC(C)C)NC(=O)C(C(C)C)NC(=O)C(C(C)C)NC(=O)CC(C)C)O

InChIKey: FAXGPCHRFPCXOO-LXTPJMTPSA-N

InChI: 1S/C34H63N5O9/c1-17(2)12-23(37-33(47)31(21(9)10)39-34(48)30(20(7)8)38-27(42)14-19(5)6)25(40)15-28(43)35-22(11)32(46)36-24(13-18(3)4)26(41)16-29(44)45/h17-26,30-31,40-41H,12-16H2,1-11H3,(H,35,43)(H,36,See more
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克立咪唑
- ≥98%
CAS号: 442-52-4 EC号: 207-133-5

分子式: C₁₉H₂₀ClN₃ 分子量: 325.84

IUPAC Name: 1-[(4-chlorophenyl)methyl]-2-(pyrrolidin-1-ylmethyl)benzimidazole

SMILES: C1CCN(C1)CC2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)Cl

InChIKey: CJXAEXPPLWQRFR-UHFFFAOYSA-N

InChI: 1S/C19H20ClN3/c20-16-9-7-15(8-10-16)13-23-18-6-2-1-5-17(18)21-19(23)14-22-11-3-4-12-22/h1-2,5-10H,3-4,11-14H2
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组织蛋白酶抑制剂1
- ≥99%
CAS号: 225120-65-0 Compound CID : 44224135

分子式: C₂₀H₂₄ClN₅O₂ 分子量: 401.89

IUPAC Name: 5-tert-butyl-N-[(2S)-3-(3-chlorophenyl)-1-(cyanomethylamino)-1-oxopropan-2-yl]-2-methylpyrazole-3-carboxamide

SMILES: CC(C)(C)C1=NN(C(=C1)C(=O)NC(CC2=CC(=CC=C2)Cl)C(=O)NCC#N)C

InChIKey: MZRVIHRERYCHBL-HNNXBMFYSA-N

InChI: 1S/C20H24ClN5O2/c1-20(2,3)17-12-16(26(4)25-17)19(28)24-15(18(27)23-9-8-22)11-13-6-5-7-14(21)10-13/h5-7,10,12,15H,9,11H2,1-4H3,(H,23,27)(H,24,28)/t15-/m0/s1
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E-64,半胱氨酸蛋白酶抑制剂
- ≥99%
- protease inhibitor
CAS号: 66701-25-5

分子式: C₁₅H₂₇N₅O₅ 分子量: 357.41

IUPAC Name: (2S,3S)-3-[[(2S)-1-[4-(diaminomethylideneamino)butylamino]-4-methyl-1-oxopentan-2-yl]carbamoyl]oxirane-2-carboxylic acid

SMILES: CC(C)C[C@H](NC(=O)[C@@H]1O[C@H]1C(O)=O)C(=O)NCCCCNC(N)=N

InChIKey: LTLYEAJONXGNFG-DCAQKATOSA-N

InChI: 1S/C15H27N5O5/c1-8(2)7-9(20-13(22)10-11(25-10)14(23)24)12(21)18-5-3-4-6-19-15(16)17/h8-11H,3-7H2,1-2H3,(H,18,21)(H,20,22)(H,23,24)(H4,16,17,19)/t9-,10-,11-/m0/s1
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S-[4-[(4-硝基苄基)氧代]苯乙基]异硫脲甲磺酸盐
- ≥98%(HPLC)
CAS号: 182004-65-5 Compound CID : 9823846

分子式: C₁₆H₁₇N₃O₃S·CH₄O₃S 分子量: 427.49

IUPAC Name: methanesulfonic acid;2-[4-[(4-nitrophenyl)methoxy]phenyl]ethyl carbamimidothioate

SMILES: CS(=O)(=O)O.C1=CC(=CC=C1CCSC(=N)N)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChIKey: WGIKEBHIKKWJLG-UHFFFAOYSA-N

InChI: 1S/C16H17N3O3S.CH4O3S/c17-16(18)23-10-9-12-3-7-15(8-4-12)22-11-13-1-5-14(6-2-13)19(20)21;1-5(2,3)4/h1-8H,9-11H2,(H3,17,18);1H3,(H,2,3,4)
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SF1670,PTEN抑制剂
- ≥98%
CAS号: 345630-40-2 Compound CID : 9926586

分子式: C₁₉H₁₇NO₃ 分子量: 307.35

IUPAC Name: N-(9,10-dioxophenanthren-2-yl)-2,2-dimethylpropanamide

SMILES: CC(C)(C)C(=O)NC1=CC2=C(C=C1)C3=CC=CC=C3C(=O)C2=O

InChIKey: VZQDDSYKVYARDW-UHFFFAOYSA-N

InChI: 1S/C19H17NO3/c1-19(2,3)18(23)20-11-8-9-13-12-6-4-5-7-14(12)16(21)17(22)15(13)10-11/h4-10H,1-3H3,(H,20,23)
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N-(4-戊基肉桂酰胺)邻氨基苯甲酸(ACA)
- ≥96%
CAS号: 110683-10-8

分子式: C₂₁H₂₃NO₃ 分子量: 337.4

IUPAC Name: 2-[[(E)-3-(4-pentylphenyl)prop-2-enoyl]amino]benzoic acid

SMILES: CCCCCC1=CC=C(C=C1)C=CC(=O)NC2=CC=CC=C2C(=O)O

InChIKey: GAMRBCZMOOMBSQ-CCEZHUSRSA-N

InChI: 1S/C21H23NO3/c1-2-3-4-7-16-10-12-17(13-11-16)14-15-20(23)22-19-9-6-5-8-18(19)21(24)25/h5-6,8-15H,2-4,7H2,1H3,(H,22,23)(H,24,25)/b15-14+
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Pyr3,TRPC3通道阻止器
- ≥98%
CAS号: 1160514-60-2 Compound CID : 56964346

分子式: C₁₆H₁₁Cl₃F₃N₃O₃ 分子量: 456.64

IUPAC Name: ethyl 1-[4-(2,3,3-trichloroprop-2-enoylamino)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxylate

SMILES: CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)NC(=O)C(=C(Cl)Cl)Cl)C(F)(F)F

InChIKey: RZHGONNSASQOAY-UHFFFAOYSA-N

InChI: 1S/C16H11Cl3F3N3O3/c1-2-28-15(27)10-7-23-25(12(10)16(20,21)22)9-5-3-8(4-6-9)24-14(26)11(17)13(18)19/h3-7H,2H2,1H3,(H,24,26)
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YM-58483 (BTP2）
- ≥98%
CAS号: 223499-30-7 EC号: 636-569-2 Compound CID : 2455

分子式: C₁₅H₉F₆N₅OS 分子量: 421.32

IUPAC Name: N-[4-[3,5-bis(trifluoromethyl)pyrazol-1-yl]phenyl]-4-methylthiadiazole-5-carboxamide

SMILES: CC1=C(SN=N1)C(=O)NC2=CC=C(C=C2)N3C(=CC(=N3)C(F)(F)F)C(F)(F)F

InChIKey: XPRZIORDEVHURQ-UHFFFAOYSA-N

InChI: 1S/C15H9F6N5OS/c1-7-12(28-25-23-7)13(27)22-8-2-4-9(5-3-8)26-11(15(19,20)21)6-10(24-26)14(16,17)18/h2-6H,1H3,(H,22,27)
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SID 26681509,人组织蛋白酶L抑制剂
- ≥95%
CAS号: 958772-66-2 Compound CID : 16725315

分子式: C₂₇H₃₃N₅O₅S 分子量: 539.65

IUPAC Name: tert-butyl N-[(2S)-1-[2-[2-(2-ethylanilino)-2-oxoethyl]sulfanylcarbonylhydrazinyl]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate

SMILES: CCC1=CC=CC=C1NC(=O)CSC(=O)NNC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)OC(C)(C)C

InChIKey: OTIWAYTTYNFEKL-QFIPXVFZSA-N

InChI: 1S/C27H33N5O5S/c1-5-17-10-6-8-12-20(17)29-23(33)16-38-26(36)32-31-24(34)22(30-25(35)37-27(2,3)4)14-18-15-28-21-13-9-7-11-19(18)21/h6-13,15,22,28H,5,14,16H2,1-4H3,(H,29,33)(H,30,35)(H,31,34)(H,32,36)/tSee more
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钙肽素
- ≥95%
CAS号: 117591-20-5

分子式: C₂₀H₃₀N₂O₄ 分子量: 362.47

IUPAC Name: benzyl N-[(2S)-4-methyl-1-oxo-1-[[(2S)-1-oxohexan-2-yl]amino]pentan-2-yl]carbamate

SMILES: CCCCC(C=O)NC(=O)C(CC(C)C)NC(=O)OCC1=CC=CC=C1

InChIKey: PGGUOGKHUUUWAF-ROUUACIJSA-N

InChI: 1S/C20H30N2O4/c1-4-5-11-17(13-23)21-19(24)18(12-15(2)3)22-20(25)26-14-16-9-7-6-8-10-16/h6-10,13,15,17-18H,4-5,11-12,14H2,1-3H3,(H,21,24)(H,22,25)/t17-,18-/m0/s1
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