激动剂、拮抗剂和抑制剂-生物科学-阿拉丁aladdin

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甲苯磺酸索拉非尼
- ≥99%
CAS号: 475207-59-1 Compound CID : 406563

分子式: C₂₁H₁₆ClF₃N₄O₃·C₇H₈O₃S 分子量: 637.03

IUPAC Name: 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]-N-methylpyridine-2-carboxamide;4-methylbenzenesulfonic acid

SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.CNC(=O)C1=NC=CC(=C1)OC2=CC=C(C=C2)NC(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F

InChIKey: IVDHYUQIDRJSTI-UHFFFAOYSA-N

InChI: 1S/C21H16ClF3N4O3.C7H8O3S/c1-26-19(30)18-11-15(8-9-27-18)32-14-5-2-12(3-6-14)28-20(31)29-13-4-7-17(22)16(10-13)21(23,24)25;1-6-2-4-7(5-3-6)11(8,9)10/h2-11H,1H3,(H,26,30)(H2,28,29,31);2-5H,1H3,(H,8,9,1See more
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(2S,3S,4E)-2-氨基十八烷基-4-烯-1,3-二醇
- ≥99%
CAS号: 25695-95-8

分子式: C₁₈H₃₇NO₂ 分子量: 299.492

IUPAC Name: (E,2S,3S)-2-aminooctadec-4-ene-1,3-diol

SMILES: CCCCCCCCCCCCCC=CC(C(CO)N)O

InChIKey: WWUZIQQURGPMPG-DNWQSSKHSA-N

InChI: 1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18-/m0/s1
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Silvestrol,抑制剂
- ≥99%
CAS号: 697235-38-4

分子式: C₃₄H₃₈O₁₃ 分子量: 654.66

IUPAC Name: methyl (1R,2R,3S,3aR,8bS)-6-[[(2S,3R,6R)-6-[(1R)-1,2-dihydroxyethyl]-3-methoxy-1,4-dioxan-2-yl]oxy]-1,8b-dihydroxy-8-methoxy-3a-(4-methoxyphenyl)-3-phenyl-2,3-dihydro-1H-cyclopenta[b][1]benzofuran-2-cSee more

SMILES: COC1C(OC(CO1)C(CO)O)OC2=CC3=C(C(=C2)OC)C4(C(C(C(C4(O3)C5=CC=C(C=C5)OC)C6=CC=CC=C6)C(=O)OC)O)O

InChIKey: GVKXFVCXBFGBCD-QKDMMWSPSA-N

InChI: 1S/C34H38O13/c1-40-20-12-10-19(11-13-20)34-27(18-8-6-5-7-9-18)26(30(38)42-3)29(37)33(34,39)28-23(41-2)14-21(15-24(28)47-34)45-32-31(43-4)44-17-25(46-32)22(36)16-35/h5-15,22,25-27,29,31-32,35-37,39H,16See more
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可可碱
- ≥99%
CAS号: 83-67-0 EC号: 201-494-2

分子式: C₇H₈N₄O₂ 分子量: 180.16

IUPAC Name: 3,7-dimethylpurine-2,6-dione

SMILES: CN1C=NC2=C1C(=O)NC(=O)N2C

InChIKey: YAPQBXQYLJRXSA-UHFFFAOYSA-N

InChI: 1S/C7H8N4O2/c1-10-3-8-5-4(10)6(12)9-7(13)11(5)2/h3H,1-2H3,(H,9,12,13)
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TAME,APC抑制剂
- ≥99%
CAS号: 901-47-3

分子式: C₁₄H₂₂N₄O₄S 分子量: 342.41

IUPAC Name: methyl (2S)-5-(diaminomethylideneamino)-2-[(4-methylphenyl)sulfonylamino]pentanoate

SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC(CCCN=C(N)N)C(=O)OC

InChIKey: FKMJXALNHKIDOD-LBPRGKRZSA-N

InChI: 1S/C14H22N4O4S/c1-10-5-7-11(8-6-10)23(20,21)18-12(13(19)22-2)4-3-9-17-14(15)16/h5-8,12,18H,3-4,9H2,1-2H3,(H4,15,16,17)/t12-/m0/s1
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Thiazovivin,Rho激酶抑制剂
- ≥99%
CAS号: 1226056-71-8

分子式: C₁₅H₁₃N₅OS 分子量: 311.36

IUPAC Name: N-benzyl-2-(pyrimidin-4-ylamino)-1,3-thiazole-4-carboxamide

SMILES: C1=CC=C(C=C1)CNC(=O)C2=CSC(=N2)NC3=NC=NC=C3

InChIKey: DOBKQCZBPPCLEG-UHFFFAOYSA-N

InChI: 1S/C15H13N5OS/c21-14(17-8-11-4-2-1-3-5-11)12-9-22-15(19-12)20-13-6-7-16-10-18-13/h1-7,9-10H,8H2,(H,17,21)(H,16,18,19,20)
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盐酸托哌酮
- ≥99%
CAS号: 3644-61-9

分子式: C₁₆H₂₃NO·HCl 分子量: 281.82

IUPAC Name: 2-methyl-1-(4-methylphenyl)-3-piperidin-1-ylpropan-1-one;hydrochloride

SMILES: CC1=CC=C(C=C1)C(=O)C(C)CN2CCCCC2.Cl

InChIKey: ZBUVYROEHQQAKL-UHFFFAOYSA-N

InChI: 1S/C16H23NO.ClH/c1-13-6-8-15(9-7-13)16(18)14(2)12-17-10-4-3-5-11-17;/h6-9,14H,3-5,10-12H2,1-2H3;1H
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凝血氧烷 B2 (TXB2)
- ≥99%
CAS号: 54397-85-2 Compound CID : 5283137

分子式: C₂₀H₃₄O₆ 分子量: 370.48

IUPAC Name: (Z)-7-[(2R,3S,4S)-4,6-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]oxan-3-yl]hept-5-enoic acid

SMILES: CCCCCC(C=CC1C(C(CC(O1)O)O)CC=CCCCC(=O)O)O

InChIKey: XNRNNGPBEPRNAR-JQBLCGNGSA-N

InChI: 1S/C20H34O6/c1-2-3-6-9-15(21)12-13-18-16(17(22)14-20(25)26-18)10-7-4-5-8-11-19(23)24/h4,7,12-13,15-18,20-22,25H,2-3,5-6,8-11,14H2,1H3,(H,23,24)/b7-4-,13-12+/t15-,16-,17-,18+,20?/m0/s1
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熊去氧胆酸（UDCA）
- ≥99%
CAS号: 128-13-2 EC号: 204-879-3

分子式: C₂₄H₄₀O₄ 分子量: 392.57

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

SMILES: CC(CCC(=O)O)C1CCC2C1(CCC3C2C(CC4C3(CCC(C4)O)C)O)C

InChIKey: RUDATBOHQWOJDD-UZVSRGJWSA-N

InChI: 1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,20+,22+,23+,24-/m1/s1
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瓦他拉尼 (PTK787)二盐酸盐
- ≥99%
CAS号: 212141-51-0 Compound CID : 22386467

分子式: C₂₀H₁₅ClN₄.2HCl 分子量: 419.74

IUPAC Name: N-(4-chlorophenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-amine;dihydrochloride

SMILES: C1=CC=C2C(=C1)C(=NN=C2NC3=CC=C(C=C3)Cl)CC4=CC=NC=C4.Cl.Cl

InChIKey: AZUQEHCMDUSRLH-UHFFFAOYSA-N

InChI: 1S/C20H15ClN4.2ClH/c21-15-5-7-16(8-6-15)23-20-18-4-2-1-3-17(18)19(24-25-20)13-14-9-11-22-12-10-14;;/h1-12H,13H2,(H,23,25);2*1H
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VX-222（VCH-222,Lomibuvir）,非核苷抑制剂
- ≥99%
CAS号: 1026785-59-0 Compound CID : 24798764

分子式: C₂₅H₃₅NO₄S 分子量: 445.63

IUPAC Name: 5-(3,3-dimethylbut-1-ynyl)-3-[(4-hydroxycyclohexyl)-(4-methylcyclohexanecarbonyl)amino]thiophene-2-carboxylic acid

SMILES: CC1CCC(CC1)C(=O)N(C2CCC(CC2)O)C3=C(SC(=C3)C#CC(C)(C)C)C(=O)O

InChIKey: WPMJNLCLKAKMLA-UHFFFAOYSA-N

InChI: 1S/C25H35NO4S/c1-16-5-7-17(8-6-16)23(28)26(18-9-11-19(27)12-10-18)21-15-20(13-14-25(2,3)4)31-22(21)24(29)30/h15-19,27H,5-12H2,1-4H3,(H,29,30)
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VUF 10166,5-HT3拮抗剂
- ≥99%
CAS号: 155584-74-0 Compound CID : 24278976

分子式: C₁₃H₁₅ClN₄ 分子量: 262.74

IUPAC Name: 2-chloro-3-(4-methylpiperazin-1-yl)quinoxaline

SMILES: CN1CCN(CC1)C2=NC3=CC=CC=C3N=C2Cl

InChIKey: FFXVTQDGTKEXHF-UHFFFAOYSA-N

InChI: 1S/C13H15ClN4/c1-17-6-8-18(9-7-17)13-12(14)15-10-4-2-3-5-11(10)16-13/h2-5H,6-9H2,1H3
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