激动剂、拮抗剂和抑制剂-生物科学-阿拉丁aladdin

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AP26113
- ≥98%
CAS号 : 1197958-12-5 Compound CID : 57390074

分子式: C₂₆H₃₄ClN₆O₂P 分子量: 529.01

IUPAC Name: 5-chloro-2-N-[4-[4-(dimethylamino)piperidin-1-yl]-2-methoxyphenyl]-4-N-(2-dimethylphosphorylphenyl)pyrimidine-2,4-diamine

SMILES: CN(C)C1CCN(CC1)C2=CC(=C(C=C2)NC3=NC=C(C(=N3)NC4=CC=CC=C4P(=O)(C)C)Cl)OC

InChIKey: OVDSPTSBIQCAIN-UHFFFAOYSA-N

InChI: InChI=1S/C26H34ClN6O2P/c1-32(2)18-12-14-33(15-13-18)19-10-11-21(23(16-19)35-3)30-26-28-17-20(27)25(31-26)29-22-8-6-7-9-24(22)36(4,5)34/h6-11,16-18H,12-15H2,1-5H3,(H2,28,29,30,31)
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阿法替尼
- ≥95%
CAS号 : 439081-18-2 Compound CID : 10184653

分子式: C₂₄H₂₅ClFN₅O₃ 分子量: 485.94

IUPAC Name: (E)-N-[4-(3-chloro-4-fluoroanilino)-7-[(3S)-oxolan-3-yl]oxyquinazolin-6-yl]-4-(dimethylamino)but-2-enamide

SMILES: CN(C)CC=CC(=O)NC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=C(C=C3)F)Cl)OC4CCOC4

InChIKey: ULXXDDBFHOBEHA-CWDCEQMOSA-N

InChI: InChI=1S/C24H25ClFN5O3/c1-31(2)8-3-4-23(32)30-21-11-17-20(12-22(21)34-16-7-9-33-13-16)27-14-28-24(17)29-15-5-6-19(26)18(25)10-15/h3-6,10-12,14,16H,7-9,13H2,1-2H3,(H,30,32)(H,27,28,29)/b4-3+/t16-/m0/s1
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AEE788 (NVP-AEE788),EGFR和VEGFR抑制剂
- ≥97%
CAS号 : 497839-62-0 Compound CID : 10297043

分子式: C₂₇H₃₂N₆ 分子量: 440.58

IUPAC Name: 6-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]-N-[(1R)-1-phenylethyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine

SMILES: CCN1CCN(CC1)CC2=CC=C(C=C2)C3=CC4=C(N3)N=CN=C4NC(C)C5=CC=CC=C5

InChIKey: OONFNUWBHFSNBT-HXUWFJFHSA-N

InChI: InChI=1S/C27H32N6/c1-3-32-13-15-33(16-14-32)18-21-9-11-23(12-10-21)25-17-24-26(28-19-29-27(24)31-25)30-20(2)22-7-5-4-6-8-22/h4-12,17,19-20H,3,13-16,18H2,1-2H3,(H2,28,29,30,31)/t20-/m1/s1
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L-去甲肾上腺素
- ≥98%
CAS号 : 51-41-2 Compound CID : 439260

分子式: C₈H₁₁NO₃ 分子量: 169.18

IUPAC Name: 4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol

SMILES: C1=CC(=C(C=C1C(CN)O)O)O

InChIKey: SFLSHLFXELFNJZ-QMMMGPOBSA-N

InChI: InChI=1S/C8H11NO3/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8,10-12H,4,9H2/t8-/m0/s1
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PD153035,EGFR酪氨酸激酶抑制剂
- ≥98%
CAS号 : 153436-54-5 Compound CID : 4705

分子式: C₁₆H₁₄BrN₃O₂ 分子量: 360.21

IUPAC Name: N-(3-bromophenyl)-6,7-dimethoxyquinazolin-4-amine

SMILES: COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=CC=C3)Br)OC

InChIKey: LSPANGZZENHZNJ-UHFFFAOYSA-N

InChI: InChI=1S/C16H14BrN3O2/c1-21-14-7-12-13(8-15(14)22-2)18-9-19-16(12)20-11-5-3-4-10(17)6-11/h3-9H,1-2H3,(H,18,19,20)
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PD168393,细胞渗透性EGFR抑制剂
- ≥98%
CAS号 : 194423-15-9 Compound CID : 4708

分子式: C₁₇H₁₃BrN₄O 分子量: 369.22

IUPAC Name: N-[4-(3-bromoanilino)quinazolin-6-yl]prop-2-enamide

SMILES: C=CC(=O)NC1=CC2=C(C=C1)N=CN=C2NC3=CC(=CC=C3)Br

InChIKey: HTUBKQUPEREOGA-UHFFFAOYSA-N

InChI: InChI=1S/C17H13BrN4O/c1-2-16(23)21-13-6-7-15-14(9-13)17(20-10-19-15)22-12-5-3-4-11(18)8-12/h2-10H,1H2,(H,21,23)(H,19,20,22)
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西洛多辛
- ≥99%
CAS号 : 160970-54-7 Compound CID : 5312125

分子式: C₂₅H₃₂F₃N₃O₄ 分子量: 495.53

IUPAC Name: 1-(3-hydroxypropyl)-5-[(2R)-2-[2-[2-(2,2,2-trifluoroethoxy)phenoxy]ethylamino]propyl]-2,3-dihydroindole-7-carboxamide

SMILES: NC(C1=CC(C[C@@H](C)NCCOC2=C(OCC(F)(F)F)C=CC=C2)=CC3=C1N(CCCO)CC3)=O

InChIKey: PNCPYILNMDWPEY-QGZVFWFLSA-N

InChI: InChI=1S/C25H32F3N3O4/c1-17(30-8-12-34-21-5-2-3-6-22(21)35-16-25(26,27)28)13-18-14-19-7-10-31(9-4-11-32)23(19)20(15-18)24(29)33/h2-3,5-6,14-15,17,30,32H,4,7-13,16H2,1H3,(H2,29,33)/t17-/m1/s1
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TAK-285
- ≥98%
CAS号 : 871026-44-7 Compound CID : 11620908

分子式: C₂₆H₂₅ClF₃N₅O₃ 分子量: 547.96

IUPAC Name: N-[2-[4-[3-chloro-4-[3-(trifluoromethyl)phenoxy]anilino]pyrrolo[3,2-d]pyrimidin-5-yl]ethyl]-3-hydroxy-3-methylbutanamide

SMILES: CC(C)(CC(=O)NCCN1C=CC2=C1C(=NC=N2)NC3=CC(=C(C=C3)OC4=CC=CC(=C4)C(F)(F)F)Cl)O

InChIKey: ZYQXEVJIFYIBHZ-UHFFFAOYSA-N

InChI: InChI=1S/C26H25ClF3N5O3/c1-25(2,37)14-22(36)31-9-11-35-10-8-20-23(35)24(33-15-32-20)34-17-6-7-21(19(27)13-17)38-18-5-3-4-16(12-18)26(28,29)30/h3-8,10,12-13,15,37H,9,11,14H2,1-2H3,(H,31,36)(H,32,33,34)
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BMY 7378 二盐酸盐
- ≥98%
CAS号 : 21102-95-4 Compound CID : 210172

分子式: C₂₂H₃₁N₃O₃·2HCl 分子量: 458.42

IUPAC Name: 8-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-8-azaspiro[4.5]decane-7,9-dione;dihydrochloride

SMILES: COC1=CC=CC=C1N2CCN(CC2)CCN3C(=O)CC4(CCCC4)CC3=O.Cl.Cl

InChIKey: NIBOMXUDFLRHRV-UHFFFAOYSA-N

InChI: InChI=1S/C22H31N3O3.2ClH/c1-28-19-7-3-2-6-18(19)24-13-10-23(11-14-24)12-15-25-20(26)16-22(17-21(25)27)8-4-5-9-22;;/h2-3,6-7H,4-5,8-17H2,1H3;2*1H
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卡维地洛
- ≥98%(HPLC)
CAS号 : 72956-09-3 Compound CID : 2585

分子式: C₂₄H₂₆N₂O₄ 分子量: 406.47

IUPAC Name: 1-(9H-carbazol-4-yloxy)-3-[2-(2-methoxyphenoxy)ethylamino]propan-2-ol

SMILES: COC1=CC=CC=C1OCCNCC(COC2=CC=CC3=C2C4=CC=CC=C4N3)O

InChIKey: OGHNVEJMJSYVRP-UHFFFAOYSA-N

InChI: InChI=1S/C24H26N2O4/c1-28-21-10-4-5-11-22(21)29-14-13-25-15-17(27)16-30-23-12-6-9-20-24(23)18-7-2-3-8-19(18)26-20/h2-12,17,25-27H,13-16H2,1H3
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达克替尼（PF299804、PF299）
- ≥99%
CAS号 : 1110813-31-4 Compound CID : 11511120

分子式: C₂₄H₂₅ClFN₅O₂ 分子量: 469.94

IUPAC Name: (E)-N-[4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-6-yl]-4-piperidin-1-ylbut-2-enamide

SMILES: COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)NC(=O)C=CCN4CCCCC4

InChIKey: LVXJQMNHJWSHET-AATRIKPKSA-N

InChI: InChI=1S/C24H25ClFN5O2/c1-33-22-14-20-17(24(28-15-27-20)29-16-7-8-19(26)18(25)12-16)13-21(22)30-23(32)6-5-11-31-9-3-2-4-10-31/h5-8,12-15H,2-4,9-11H2,1H3,(H,30,32)(H,27,28,29)/b6-5+
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二甲苯磺酸拉帕替尼一水合物
- ≥98%
CAS号 : 388082-78-8 Compound CID : 11557040

分子式: C₄₃H₄₄ClFN₄O₁₁S₃ 分子量: 943.49

IUPAC Name: N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-[5-[(2-methylsulfonylethylamino)methyl]furan-2-yl]quinazolin-4-amine;4-methylbenzenesulfonic acid;hydrate

SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=C(C=C1)S(=O)(=O)O.CS(=O)(=O)CCNCC1=CC=C(O1)C2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OCC5=CC(=CC=C5)F)Cl.O

InChIKey: XNRVGTHNYCNCFF-UHFFFAOYSA-N

InChI: InChI=1S/C29H26ClFN4O4S.2C7H8O3S.H2O/c1-40(36,37)12-11-32-16-23-7-10-27(39-23)20-5-8-26-24(14-20)29(34-18-33-26)35-22-6-9-28(25(30)15-22)38-17-19-3-2-4-21(31)13-19;2*1-6-2-4-7(5-3-6)11(8,9)10;/h2-10,13-15,18,32H,11-12,16-17H2,1H3,(H,33,34,35);2*2-5H,1H3,(H,8,9,10);1H2
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