激动剂、拮抗剂和抑制剂-生物科学-阿拉丁aladdin

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盐酸丙哌维林
- ≥98%(HPLC)
CAS号: 54556-98-8 Compound CID : 441412

分子式: C₂₃H₂₉NO₃ · HCl 分子量: 403.94

IUPAC Name: (1-methylpiperidin-4-yl) 2,2-diphenyl-2-propoxyacetate;hydrochloride

SMILES: CCCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OC3CCN(CC3)C.Cl

InChIKey: KFUJMHHNLGCTIJ-UHFFFAOYSA-N

InChI: 1S/C23H29NO3.ClH/c1-3-18-26-23(19-10-6-4-7-11-19,20-12-8-5-9-13-20)22(25)27-21-14-16-24(2)17-15-21;/h4-13,21H,3,14-18H2,1-2H3;1H
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奥昔嘌醇
- ≥98%(HPLC)
CAS号: 2465-59-0

分子式: C₅H₄N₄O₂ 分子量: 152.11

IUPAC Name: 1,7-dihydropyrazolo[3,4-d]pyrimidine-4,6-dione

SMILES: C1=NNC2=C1C(=O)NC(=O)N2

InChIKey: HXNFUBHNUDHIGC-UHFFFAOYSA-N

InChI: 1S/C5H4N4O2/c10-4-2-1-6-9-3(2)7-5(11)8-4/h1H,(H3,6,7,8,9,10,11)
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NMS-873,VCP ATPase抑制剂
- ≥98%(HPLC)
CAS号: 1418013-75-8

分子式: C₂₇H₂₈N₄O₃S₂ 分子量: 520.67

IUPAC Name: 3-[3-cyclopentylsulfanyl-5-[[3-methyl-4-(4-methylsulfonylphenyl)phenoxy]methyl]-1,2,4-triazol-4-yl]pyridine

SMILES: CC1=C(C=CC(=C1)OCC2=NN=C(N2C3=CN=CC=C3)SC4CCCC4)C5=CC=C(C=C5)S(=O)(=O)C

InChIKey: UJGTUKMAJVCBIS-UHFFFAOYSA-N

InChI: 1S/C27H28N4O3S2/c1-19-16-22(11-14-25(19)20-9-12-24(13-10-20)36(2,32)33)34-18-26-29-30-27(35-23-7-3-4-8-23)31(26)21-6-5-15-28-17-21/h5-6,9-17,23H,3-4,7-8,18H2,1-2H3
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SBE 13盐酸盐
- ≥98%(HPLC)
CAS号: 1052532-15-6 Compound CID : 11948807

分子式: C₂₄H₂₈Cl₂N₂O₄ 分子量: 479.4

IUPAC Name: N-[[4-[(6-chloropyridin-3-yl)methoxy]-3-methoxyphenyl]methyl]-2-(3,4-dimethoxyphenyl)ethanamine;hydrochloride

SMILES: COC1=C(C=C(C=C1)CCNCC2=CC(=C(C=C2)OCC3=CN=C(C=C3)Cl)OC)OC.Cl

InChIKey: QBGSVDJLQQXEGG-UHFFFAOYSA-N

InChI: 1S/C24H27ClN2O4.ClH/c1-28-20-7-4-17(12-22(20)29-2)10-11-26-14-18-5-8-21(23(13-18)30-3)31-16-19-6-9-24(25)27-15-19;/h4-9,12-13,15,26H,10-11,14,16H2,1-3H3;1H
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PK11007,P53靶向化合物
- ≥98%(HPLC)
CAS号: 38275-34-2 Compound CID : 1241459

分子式: C₆H₅ClN₂O₄S 分子量: 236.63

IUPAC Name: 5-chloro-2-methylsulfonylpyrimidine-4-carboxylic acid

SMILES: CS(=O)(=O)C1=NC=C(C(=N1)C(=O)O)Cl

InChIKey: WZUPWJVRWIVWEF-UHFFFAOYSA-N

InChI: 1S/C6H5ClN2O4S/c1-14(12,13)6-8-2-3(7)4(9-6)5(10)11/h2H,1H3,(H,10,11)
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双环醇
- ≥98%(HPLC)
CAS号: 118159-48-1

分子式: C₁₉H₁₈O₉ 分子量: 390.34

IUPAC Name: methyl 4-[5-(hydroxymethyl)-7-methoxy-1,3-benzodioxol-4-yl]-7-methoxy-1,3-benzodioxole-5-carboxylate

SMILES: COC1=C2C(=C(C(=C1)CO)C3=C4C(=C(C=C3C(=O)OC)OC)OCO4)OCO2

InChIKey: KXMTXZACPVCDMH-UHFFFAOYSA-N

InChI: 1S/C19H18O9/c1-22-11-4-9(6-20)13(17-15(11)25-7-27-17)14-10(19(21)24-3)5-12(23-2)16-18(14)28-8-26-16/h4-5,20H,6-8H2,1-3H3
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巴泽多昔芬醋酸盐
- ≥98%(HPLC)
CAS号: 198481-33-3

分子式: C₃₀H₃₄N₂O₃·C₂H₄O₂ 分子量: 530.65

IUPAC Name: acetic acid;1-[[4-[2-(azepan-1-yl)ethoxy]phenyl]methyl]-2-(4-hydroxyphenyl)-3-methylindol-5-ol

SMILES: CC1=C(N(C2=C1C=C(C=C2)O)CC3=CC=C(C=C3)OCCN4CCCCCC4)C5=CC=C(C=C5)O.CC(=O)O

InChIKey: OMZAMQFQZMUNTP-UHFFFAOYSA-N

InChI: 1S/C30H34N2O3.C2H4O2/c1-22-28-20-26(34)12-15-29(28)32(30(22)24-8-10-25(33)11-9-24)21-23-6-13-27(14-7-23)35-19-18-31-16-4-2-3-5-17-31;1-2(3)4/h6-15,20,33-34H,2-5,16-19,21H2,1H3;1H3,(H,3,4)
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BQCA,M1受体的正变构调节剂
- ≥98%(HPLC)
CAS号: 338747-41-4

分子式: C₁₈H₁₅NO₄ 分子量: 309.32

IUPAC Name: 1-[(4-methoxyphenyl)methyl]-4-oxoquinoline-3-carboxylic acid

SMILES: COC1=CC=C(C=C1)CN2C=C(C(=O)C3=CC=CC=C32)C(=O)O

InChIKey: BZBBTGCKPRSPGF-UHFFFAOYSA-N

InChI: 1S/C18H15NO4/c1-23-13-8-6-12(7-9-13)10-19-11-15(18(21)22)17(20)14-4-2-3-5-16(14)19/h2-9,11H,10H2,1H3,(H,21,22)
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蟾毒灵
- ≥98%(HPLC)
CAS号: 465-21-4

分子式: C₂₄H₃₄O₄ 分子量: 386.52

IUPAC Name: 5-[(3S,5R,8R,9S,10S,13R,14S,17R)-3,14-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pyran-2-one

SMILES: CC12CCC(CC1CCC3C2CCC4(C3(CCC4C5=COC(=O)C=C5)O)C)O

InChIKey: QEEBRPGZBVVINN-BMPKRDENSA-N

InChI: 1S/C24H34O4/c1-22-10-7-17(25)13-16(22)4-5-20-19(22)8-11-23(2)18(9-12-24(20,23)27)15-3-6-21(26)28-14-15/h3,6,14,16-20,25,27H,4-5,7-13H2,1-2H3/t16-,17+,18-,19+,20-,22+,23-,24+/m1/s1
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克立咪唑盐酸盐
- ≥98%(HPLC)
CAS号: 1163-36-6 Compound CID : 5309446

分子式: C₁₉H₂₁Cl₂N₃ 分子量: 362.3

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

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

InChIKey: DNFMJYXRIMLMBZ-UHFFFAOYSA-N

InChI: 1S/C19H20ClN3.ClH/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;1H
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4μ8C,IRE1 RNase抑制剂
- ≥98%(HPLC)
CAS号: 14003-96-4

分子式: C₁₁H₈O₄ 分子量: 204.18

IUPAC Name: 7-hydroxy-4-methyl-2-oxochromene-8-carbaldehyde

SMILES: CC1=CC(=O)OC2=C1C=CC(=C2C=O)O

InChIKey: RTHHSXOVIJWFQP-UHFFFAOYSA-N

InChI: 1S/C11H8O4/c1-6-4-10(14)15-11-7(6)2-3-9(13)8(11)5-12/h2-5,13H,1H3
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Canertinib 二盐酸盐
- ≥98%(HPLC)
CAS号: 289499-45-2 Compound CID : 156413

分子式: C₂₄H₂₅ClFN₅O₃·2HCl 分子量: 558.86

IUPAC Name: N-[4-(3-chloro-4-fluoroanilino)-7-(3-morpholin-4-ylpropoxy)quinazolin-6-yl]prop-2-enamide;dihydrochloride

SMILES: C=CC(=O)NC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=C(C=C3)F)Cl)OCCCN4CCOCC4.Cl.Cl

InChIKey: JZZFDCXSFTVOJY-UHFFFAOYSA-N

InChI: 1S/C24H25ClFN5O3.2ClH/c1-2-23(32)30-21-13-17-20(14-22(21)34-9-3-6-31-7-10-33-11-8-31)27-15-28-24(17)29-16-4-5-19(26)18(25)12-16;;/h2,4-5,12-15H,1,3,6-11H2,(H,30,32)(H,27,28,29);2*1H
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