激动剂、拮抗剂和抑制剂-生物科学-阿拉丁aladdin

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Fexaramine,受体（FXR）激动剂
- ≥97%(HPLC)
CAS号: 574013-66-4

分子式: C₃₂H₃₆N₂O₃ 分子量: 496.64

IUPAC Name: methyl (E)-3-[3-[cyclohexanecarbonyl-[[4-[4-(dimethylamino)phenyl]phenyl]methyl]amino]phenyl]prop-2-enoate

SMILES: CN(C)C1=CC=C(C=C1)C2=CC=C(C=C2)CN(C3=CC=CC(=C3)C=CC(=O)OC)C(=O)C4CCCCC4

InChIKey: VLQTUNDJHLEFEQ-KGENOOAVSA-N

InChI: 1S/C32H36N2O3/c1-33(2)29-19-17-27(18-20-29)26-15-12-25(13-16-26)23-34(32(36)28-9-5-4-6-10-28)30-11-7-8-24(22-30)14-21-31(35)37-3/h7-8,11-22,28H,4-6,9-10,23H2,1-3H3/b21-14+
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DS2,GABAA受体的正变构调节剂
- ≥97%(HPLC)
CAS号: 374084-31-8

分子式: C₁₈H₁₂ClN₃OS 分子量: 353.83

IUPAC Name: 4-chloro-N-(2-thiophen-2-ylimidazo[1,2-a]pyridin-3-yl)benzamide

SMILES: C1=CC2=NC(=C(N2C=C1)NC(=O)C3=CC=C(C=C3)Cl)C4=CC=CS4

InChIKey: AZKMWHRDICVYEI-UHFFFAOYSA-N

InChI: 1S/C18H12ClN3OS/c19-13-8-6-12(7-9-13)18(23)21-17-16(14-4-3-11-24-14)20-15-5-1-2-10-22(15)17/h1-11H,(H,21,23)
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DQP 1105,GluN2C / GluN2DNMDA拮抗剂
- ≥97%(HPLC)
CAS号: 380560-89-4

分子式: C₂₉H₂₄BrN₃O₄ 分子量: 558.42

SMILES: O=C2C(C4=NN(C(CCC(O)=O)=O)C(C5=CC=C(Br)C=C5)C4)=C(C3=CC=CC=C3)C1=CC(C)=CC=C1N2

InChIKey: JIQFFACVQXXHMY-YDALLXLXSA-N
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CYM 5541,S1P3受体变构激动剂
- ≥97%(HPLC)
CAS号: 945128-26-7

分子式: C₁₉H₂₈N₂O₂ 分子量: 316.44

IUPAC Name: N,N-dicyclohexyl-5-cyclopropyl-1,2-oxazole-3-carboxamide

SMILES: C1CCC(CC1)N(C2CCCCC2)C(=O)C3=NOC(=C3)C4CC4

InChIKey: NDKGACIWVAOUQH-UHFFFAOYSA-N

InChI: 1S/C19H28N2O2/c22-19(17-13-18(23-20-17)14-11-12-14)21(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h13-16H,1-12H2
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CEP 1347,JNK信号传导抑制剂
- ≥97%(HPLC)
CAS号: 156177-65-0

分子式: C₃₃H₃₃N₃O₅S₂ 分子量: 615.76

IUPAC Name: methyl (15S,16R,18R)-10,23-bis(ethylsulfanylmethyl)-16-hydroxy-15-methyl-3-oxo-28-oxa-4,14,19-triazaoctacyclo[12.11.2.115,18.02,6.07,27.08,13.019,26.020,25]octacosa-1,6,8(13),9,11,20(25),21,23,26-nonaSee more

SMILES: CCSCC1=CC2=C(C=C1)N3C4CC(C(O4)(N5C6=C(C=C(C=C6)CSCC)C7=C8CNC(=O)C8=C2C3=C75)C)(C(=O)OC)O

InChIKey: SCMLRESZJCKCTC-KMYQRJGFSA-N

InChI: 1S/C33H33N3O5S2/c1-5-42-15-17-7-9-22-19(11-17)26-27-21(14-34-30(27)37)25-20-12-18(16-43-6-2)8-10-23(20)36-29(25)28(26)35(22)24-13-33(39,31(38)40-4)32(36,3)41-24/h7-12,24,39H,5-6,13-16H2,1-4H3,(H,34,37See more
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BIBX 1382 二盐酸盐
- ≥97%(HPLC)
CAS号: 1216920-18-1 Compound CID : 46861540

分子式: C₁₈H₁₉ClFN₇•2HCl 分子量: 460.77

IUPAC Name: 4-N-(3-chloro-4-fluorophenyl)-6-N-(1-methylpiperidin-4-yl)pyrimido[5,4-d]pyrimidine-4,6-diamine;dihydrochloride

SMILES: CN1CCC(CC1)NC2=NC=C3C(=N2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl.Cl.Cl

InChIKey: RFXGEKWBTCMDAW-UHFFFAOYSA-N

InChI: 1S/C18H19ClFN7.2ClH/c1-27-6-4-11(5-7-27)25-18-21-9-15-16(26-18)17(23-10-22-15)24-12-2-3-14(20)13(19)8-12;;/h2-3,8-11H,4-7H2,1H3,(H,21,25,26)(H,22,23,24);2*1H
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BIBU 1361 二盐酸盐
- ≥97%(HPLC)
CAS号: 1643609-75-9 Compound CID : 46861539

分子式: C₂₂H₂₇ClFN₇•2HCl 分子量: 516.87

IUPAC Name: N-(3-chloro-4-fluorophenyl)-6-[4-(diethylaminomethyl)piperidin-1-yl]pyrimido[5,4-d]pyrimidin-4-amine;dihydrochloride

SMILES: CCN(CC)CC1CCN(CC1)C2=NC=C3C(=N2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl.Cl.Cl

InChIKey: ZNNWCQCQUKAMGL-UHFFFAOYSA-N

InChI: 1S/C22H27ClFN7.2ClH/c1-3-30(4-2)13-15-7-9-31(10-8-15)22-25-12-19-20(29-22)21(27-14-26-19)28-16-5-6-18(24)17(23)11-16;;/h5-6,11-12,14-15H,3-4,7-10,13H2,1-2H3,(H,26,27,28);2*1H
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AR-C 118925XX,竞争性P2Y2拮抗剂
- ≥97%(HPLC)
CAS号: 216657-60-2

分子式: C₂₈H₂₃N₇O₃S 分子量: 537.59

IUPAC Name: 5-[[5-(6,13-dimethyl-2-tricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,9,12,14-heptaenyl)-2-oxo-4-sulfanylidenepyrimidin-1-yl]methyl]-N-(2H-tetrazol-5-yl)furan-2-carboxamide

SMILES: CC1=CC2=C(C=C1)C(C3=C(C=C2)C=C(C=C3)C)C4=CN(C(=O)NC4=S)CC5=CC=C(O5)C(=O)NC6=NNN=N6

InChIKey: PVKNPGQAFNALOI-UHFFFAOYSA-N

InChI: 1S/C28H23N7O3S/c1-15-3-8-20-17(11-15)5-6-18-12-16(2)4-9-21(18)24(20)22-14-35(28(37)30-26(22)39)13-19-7-10-23(38-19)25(36)29-27-31-33-34-32-27/h3-12,14,24H,13H2,1-2H3,(H,30,37,39)(H2,29,31,32,33,34,36)
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AM 114,20S蛋白酶体抑制剂
- ≥97%(HPLC)
CAS号: 856849-35-9

分子式: C₂₀H₂₁B₂NO₅ 分子量: 377.01

IUPAC Name: [4-[(E)-[(5E)-5-[(4-boronophenyl)methylidene]-1-methyl-4-oxopiperidin-3-ylidene]methyl]phenyl]boronic acid

SMILES: B(C1=CC=C(C=C1)C=C2CN(CC(=CC3=CC=C(C=C3)B(O)O)C2=O)C)(O)O

InChIKey: SRPIKXGUPAKTIZ-OTYYAQKOSA-N

InChI: 1S/C20H21B2NO5/c1-23-12-16(10-14-2-6-18(7-3-14)21(25)26)20(24)17(13-23)11-15-4-8-19(9-5-15)22(27)28/h2-11,25-28H,12-13H2,1H3/b16-10+,17-11+
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Adaptaquin,HIF-脯氨酰羟化酶2（PHD2）抑制剂
- ≥97%(HPLC)
CAS号: 385786-48-1

分子式: C₂₁H₁₆ClN₃O₂ 分子量: 377.82

IUPAC Name: 7-[(4-chlorophenyl)-[(3-hydroxypyridin-2-yl)amino]methyl]quinolin-8-ol

SMILES: C1=CC2=C(C(=C(C=C2)C(C3=CC=C(C=C3)Cl)NC4=C(C=CC=N4)O)O)N=C1

InChIKey: KKYHNYRUBSYTCZ-UHFFFAOYSA-N

InChI: 1S/C21H16ClN3O2/c22-15-8-5-14(6-9-15)18(25-21-17(26)4-2-12-24-21)16-10-7-13-3-1-11-23-19(13)20(16)27/h1-12,18,26-27H,(H,24,25)
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ACHP,IKKα和IKKβ抑制剂
- ≥97%(HPLC)
CAS号: 406208-42-2

分子式: C₂₁H₂₄N₄O₂ 分子量: 364.44

IUPAC Name: 2-amino-6-[2-(cyclopropylmethoxy)-6-hydroxyphenyl]-4-piperidin-4-ylpyridine-3-carbonitrile

SMILES: C1CC1COC2=CC=CC(=C2C3=NC(=C(C(=C3)C4CCNCC4)C#N)N)O

InChIKey: DYVFBWXIOCLHPP-UHFFFAOYSA-N

InChI: 1S/C21H24N4O2/c22-11-16-15(14-6-8-24-9-7-14)10-17(25-21(16)23)20-18(26)2-1-3-19(20)27-12-13-4-5-13/h1-3,10,13-14,24,26H,4-9,12H2,(H2,23,25)
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A37,ALDH1A1抑制剂
- ≥97%(HPLC)
CAS号: 896795-60-1

分子式: C₂₁H₂₅N₃O₃S₂ 分子量: 431.57

IUPAC Name: ethyl 2-[[4-oxo-3-(3-pyrrolidin-1-ylpropyl)-[1]benzothiolo[3,2-d]pyrimidin-2-yl]sulfanyl]acetate

SMILES: CCOC(=O)CSC1=NC2=C(C(=O)N1CCCN3CCCC3)SC4=CC=CC=C42

InChIKey: SKDRHRAYBYQVNU-UHFFFAOYSA-N

InChI: 1S/C21H25N3O3S2/c1-2-27-17(25)14-28-21-22-18-15-8-3-4-9-16(15)29-19(18)20(26)24(21)13-7-12-23-10-5-6-11-23/h3-4,8-9H,2,5-7,10-14H2,1H3
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