激动剂、拮抗剂和抑制剂-生物科学-阿拉丁aladdin

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E-64,半胱氨酸蛋白酶抑制剂
- ≥99%
- protease inhibitor
CAS号 : 66701-25-5 Compound CID : 123985

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)CC(C(=O)NCCCCN=C(N)N)NC(=O)C1C(O1)C(=O)O

InChIKey: LTLYEAJONXGNFG-DCAQKATOSA-N

InChI: 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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L 006235,组织蛋白酶K抑制剂
- ≥98%(HPLC)
CAS号 : 294623-49-7 Compound CID : 9912381

分子式: C₂₄H₃₀N₆O₂S 分子量: 466.6

IUPAC Name: N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-[2-(4-methylpiperazin-1-yl)-1,3-thiazol-4-yl]benzamide

SMILES: CN1CCN(CC1)C2=NC(=CS2)C3=CC=C(C=C3)C(=O)NC4(CCCCC4)C(=O)NCC#N

InChIKey: FIVYCSWOCXEWSE-UHFFFAOYSA-N

InChI: InChI=1S/C24H30N6O2S/c1-29-13-15-30(16-14-29)23-27-20(17-33-23)18-5-7-19(8-6-18)21(31)28-24(9-3-2-4-10-24)22(32)26-12-11-25/h5-8,17H,2-4,9-10,12-16H2,1H3,(H,26,32)(H,28,31)
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Cathepsin L inhibitor inhibitor
- ≥95%
CAS号 : 167498-29-5 Compound CID : 10456222

分子式: C₂₆H₂₆N₂O₅ 分子量: 446.49

IUPAC Name: benzyl N-[(2S)-1-[[(2S)-1-(4-hydroxyphenyl)-3-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate

SMILES: C1=CC=C(C=C1)CC(C(=O)NC(CC2=CC=C(C=C2)O)C=O)NC(=O)OCC3=CC=CC=C3

InChIKey: QVDJMLQSYRSZKC-UPVQGACJSA-N

InChI: InChI=1S/C26H26N2O5/c29-17-22(15-20-11-13-23(30)14-12-20)27-25(31)24(16-19-7-3-1-4-8-19)28-26(32)33-18-21-9-5-2-6-10-21/h1-14,17,22,24,30H,15-16,18H2,(H,27,31)(H,28,32)/t22-,24-/m0/s1
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Odanacatib (MK-0822)
- 10mM in DMSO
CAS号 : 603139-19-1(DMSO)

分子式: C₂₅H₂₇F₄N₃O₃S 分子量: 525.56

SMILES: CC(C)(F)CC(NC(C1=CC=C(C=C1)C2=CC=C(C=C2)[S](C)(=O)=O)C(F)(F)F)C(=O)NC3(CC3)C#N
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Cruzain-IN-1
- ≥98%
CAS号 : 1199523-24-4 Compound CID : 44143088

分子式: C₁₄H₁₀F₂N₆ 分子量: 300.27

IUPAC Name: 6-(3,5-difluoroanilino)-9-ethylpurine-2-carbonitrile

SMILES: CCN1C=NC2=C(N=C(N=C21)C#N)NC3=CC(=CC(=C3)F)F

InChIKey: SZYYBVWPURUFRR-UHFFFAOYSA-N

InChI: InChI=1S/C14H10F2N6/c1-2-22-7-18-12-13(20-11(6-17)21-14(12)22)19-10-4-8(15)3-9(16)5-10/h3-5,7H,2H2,1H3,(H,19,20,21)
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巴厘卡提
- 10mM in DMSO
CAS号 : 354813-19-7 Compound CID : 10201696

分子式: C₂₃H₃₃N₅O₂ 分子量: 411.54

IUPAC Name: N-[1-(cyanomethylcarbamoyl)cyclohexyl]-4-(4-propylpiperazin-1-yl)benzamide

SMILES: CCCN1CCN(CC1)C2=CC=C(C=C2)C(=O)NC3(CCCCC3)C(=O)NCC#N

InChIKey: LLCRBOWRJOUJAE-UHFFFAOYSA-N

InChI: InChI=1S/C23H33N5O2/c1-2-14-27-15-17-28(18-16-27)20-8-6-19(7-9-20)21(29)26-23(10-4-3-5-11-23)22(30)25-13-12-24/h6-9H,2-5,10-11,13-18H2,1H3,(H,25,30)(H,26,29)
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Calpeptin
- 10mM in DMSO
CAS号 : 117591-20-5 Compound CID : 73364

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: 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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Cruzain-IN-1
- 10mM in DMSO
CAS号 : 1199523-24-4 Compound CID : 44143088

分子式: C₁₄H₁₀F₂N₆ 分子量: 300.27

IUPAC Name: 6-(3,5-difluoroanilino)-9-ethylpurine-2-carbonitrile

SMILES: CCN1C=NC2=C(N=C(N=C21)C#N)NC3=CC(=CC(=C3)F)F

InChIKey: SZYYBVWPURUFRR-UHFFFAOYSA-N

InChI: InChI=1S/C14H10F2N6/c1-2-22-7-18-12-13(20-11(6-17)21-14(12)22)19-10-4-8(15)3-9(16)5-10/h3-5,7H,2H2,1H3,(H,19,20,21)
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E-64
- 10mM in DMSO
CAS号 : 66701-25-5 Compound CID : 123985

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)CC(C(=O)NCCCCN=C(N)N)NC(=O)C1C(O1)C(=O)O

InChIKey: LTLYEAJONXGNFG-DCAQKATOSA-N

InChI: 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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波普瑞韦
- 10mM in DMSO
CAS号 : 394730-60-0(DMSO) Compound CID : 10324367

分子式: C₂₇H₄₅N₅O₅ 分子量: 519.68

IUPAC Name: (1R,2S,5S)-N-(4-amino-1-cyclobutyl-3,4-dioxobutan-2-yl)-3-[(2S)-2-(tert-butylcarbamoylamino)-3,3-dimethylbutanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide

SMILES: CC1(C2C1C(N(C2)C(=O)C(C(C)(C)C)NC(=O)NC(C)(C)C)C(=O)NC(CC3CCC3)C(=O)C(=O)N)C

InChIKey: LHHCSNFAOIFYRV-DOVBMPENSA-N

InChI: InChI=1S/C27H45N5O5/c1-25(2,3)20(30-24(37)31-26(4,5)6)23(36)32-13-15-17(27(15,7)8)18(32)22(35)29-16(19(33)21(28)34)12-14-10-9-11-14/h14-18,20H,9-13H2,1-8H3,(H2,28,34)(H,29,35)(H2,30,31,37)/t15-,16?,17-,18-,20+/m0/s1
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(S)-tert-butyl 2-oxo-1-phenylethylcarbamate
CAS号 : 163061-19-6 Compound CID : 11436272

分子式: C₁₃H₁₇NO₃ 分子量: 235.28

IUPAC Name: tert-butyl N-[(1S)-2-oxo-1-phenylethyl]carbamate

SMILES: CC(C)(C)OC(=O)NC(C=O)C1=CC=CC=C1

InChIKey: PEVGKAAGTGDOGA-LLVKDONJSA-N

InChI: InChI=1S/C13H17NO3/c1-13(2,3)17-12(16)14-11(9-15)10-7-5-4-6-8-10/h4-9,11H,1-3H3,(H,14,16)/t11-/m1/s1

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(S)-tert-butyl 1-oxobutan-2-ylcarbamate
CAS号 : 153371-25-6 Compound CID : 10241556

分子式: C₉H₁₇NO₃ 分子量: 187.24

IUPAC Name: tert-butyl N-[(2S)-1-oxobutan-2-yl]carbamate

SMILES: CCC(C=O)NC(=O)OC(C)(C)C

InChIKey: NBDAUFXJXMBQRC-ZETCQYMHSA-N

InChI: InChI=1S/C9H17NO3/c1-5-7(6-11)10-8(12)13-9(2,3)4/h6-7H,5H2,1-4H3,(H,10,12)/t7-/m0/s1

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