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JAK
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Lestaurtinib, Tyrosine-protein kinase receptor RET inhibitorCas Number: 111358-88-4Formula: C26H21N3O4 Molecular Weight: 439.46IUPAC Name: show more
SMILES: CC12C(CC(O1)N3C4=CC=CC=C4C5=C6C(=C7C8=CC=CC=C8N2C7=C53)CNC6=O)(CO)OInChIKey: UIARLYUEJFELEN-LROUJFHJSA-NInChI: show more Synonyms: SPM-924 | (5S,6S,8R)-6-hydroxy-6-(hydroxymethyl)-5-methyl-7,8,14,15-tetrahydro-5H-16-oxa-4b,8a,14-triaza-5,8-methanod... -
ZM 449829Cas Number: 4452-06-6 Compound CID: 3799Formula: C13H10O Molecular Weight: 182.22IUPAC Name: 1-naphthalen-2-ylprop-2-en-1-oneSMILES: C=CC(=O)C1=CC2=CC=CC=C2C=C1InChIKey: FOTCGZPFSUWZBN-UHFFFAOYSA-NInChI: InChI=1S/C13H10O/c1-2-13(14)12-8-7-10-5-3-4-6-11(10)9-12/h2-9H,1H2Synonyms: 1-(2-Naphthalenyl)-2-propen-1-one
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ZM 39923 HClCas Number: 1021868-92-7Formula: C23H25NO.HCl Molecular Weight: 367.91IUPAC Name: 3-[benzyl(propan-2-yl)amino]-1-naphthalen-2-ylpropan-1-one;hydrochlorideSMILES: CC(C)N(CCC(=O)C1=CC2=CC=CC=C2C=C1)CC3=CC=CC=C3.ClInChIKey: NJTUORMLOPXPBY-UHFFFAOYSA-NInChI: InChI=1S/C23H25NO.ClH/c1-18(2)24(17-19-8-4-3-5-9-19)15-14-23(25)22-13-12-20-10-6-7-11-21(20)16-22;/h3-13,16,18H,14-15,17H2,1-2H3;1HSynonyms: DTXSID301017077 | 3-BENZYLISOPROPYLAMINO-1-NAPHTHALEN-2-YL-PROPAN-1-ONE HYDROCHLORIDE | ZM39923 HCl;ZM-39923 HCl | 3-...
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CurculigosideCas Number: 85643-19-2Formula: C22H26O11 Molecular Weight: 466.44IUPAC Name: [5-hydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl 2,6-dimethoxybenzoateSMILES: COC1=C(C(=CC=C1)OC)C(=O)OCC2=C(C=CC(=C2)O)OC3C(C(C(C(O3)CO)O)O)OInChIKey: SJJRKHVKAXVFJQ-QKYBYQKWSA-NInChI: show more Synonyms: [5-hydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl2,6-dimethoxybenzoate | A6...
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SwertiamarineCas Number: 17388-39-5 Compound CID: 442435Formula: C16H22O10 Molecular Weight: 374.34IUPAC Name: (3S,4R,4aR)-4-ethenyl-4a-hydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4,5,6-tetrahydropyrano[3,4-c]pyran-8-oneSMILES: C=CC1C(OC=C2C1(CCOC2=O)O)OC3C(C(C(C(O3)CO)O)O)OInChIKey: HEYZWPRKKUGDCR-QBXMEVCASA-NInChI: show more Synonyms: A811580 | Swertiamarin, >=95% (LC/MS-ELSD) | 1H,3H-Pyrano(3,4-c)pyran-1-one, 5-ethenyl-6-(beta-D-glucopyranosyloxy)-4...
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Atractylenolide ICas Number: 73069-13-3Formula: C15H18O2 Molecular Weight: 230.3IUPAC Name: (4aS,8aS)-3,8a-dimethyl-5-methylidene-4a,6,7,8-tetrahydro-4H-benzo[f][1]benzofuran-2-oneSMILES: CC1=C2CC3C(=C)CCCC3(C=C2OC1=O)CInChIKey: ZTVSGQPHMUYCRS-SWLSCSKDSA-NInChI: InChI=1S/C15H18O2/c1-9-5-4-6-15(3)8-13-11(7-12(9)15)10(2)14(16)17-13/h8,12H,1,4-7H2,2-3H3/t12-,15+/m0/s1Synonyms: HMS3886N08 | Atractylenolide I | Atractylenolide I, >=98% (HPLC) | s8291 | (4aS,8aS)-3,8a-dimethyl-5-methylene-4a,5,6...
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Ruxolitinib phosphate salt, Tyrosine-protein kinase JAK2 inhibitorCas Number: 1092939-17-7 Compound CID: 25127112Formula: C17H21N6O4P Molecular Weight: 404.4IUPAC Name: (3R)-3-cyclopentyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]propanenitrile;phosphoric acidSMILES: C1CCC(C1)C(CC#N)N2C=C(C=N2)C3=C4C=CNC4=NC=N3.OP(=O)(O)OInChIKey: JFMWPOCYMYGEDM-XFULWGLBSA-NInChI: show more Synonyms: (R)-3-(4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl)-3-cyclopentylpropanenitrilephosphate | Jakavi (TN) | (3R)...
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LFM-A13Cas Number: 62004-35-7Formula: C11H8Br2N2O2 Molecular Weight: 360IUPAC Name: 2-cyano-N-(2,5-dibromophenyl)-3-hydroxybut-2-enamideSMILES: CC(=C(C#N)C(=O)NC1=C(C=CC(=C1)Br)Br)OInChIKey: UVSVTDVJQAJIFG-UHFFFAOYSA-NInChI: InChI=1S/C11H8Br2N2O2/c1-6(16)8(5-14)11(17)15-10-4-7(12)2-3-9(10)13/h2-4,16H,1H3,(H,15,17)Synonyms: AKOS028108222 | alpha-Cyano-beta-hydroxy-beta-methyl-N-(2,5-dibromophenyl)propenamide | KBio3_001038 | HMS3370M16 | L...
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LY2784544, Tyrosine-protein kinase JAK2 inhibitorCas Number: 1229236-86-5Formula: C23H25ClFN7O Molecular Weight: 469.95IUPAC Name: 3-[(4-chloro-2-fluorophenyl)methyl]-2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-8-(morpholin-4-ylmethyl)imidazo[1,2-b]pyridazin-6-amineSMILES: CC1=CC(=NN1)NC2=NN3C(=C(N=C3C(=C2)CN4CCOCC4)C)CC5=C(C=C(C=C5)Cl)FInChIKey: SQSZANZGUXWJEA-UHFFFAOYSA-NInChI: show more Synonyms: C23H25ClFN7O | 3-(4-chloro-2-fluorobenzyl)-2-methyl-N-(3-methyl-1H-pyrazol-5-yl)-8-(morpholinomethyl)imidazo[1,2-b]py...
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WHI-P131 hydrochlorideCas Number: 188829-39-2 Compound CID: 22022153Formula: C16H16ClN3O3 Molecular Weight: 333.77IUPAC Name: 4-[(6,7-dimethoxyquinazolin-4-yl)amino]phenol;hydrochlorideSMILES: COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=C(C=C3)O)OC.ClInChIKey: HNJNNCPPISFBGR-UHFFFAOYSA-NInChI: InChI=1S/C16H15N3O3.ClH/c1-21-14-7-12-13(8-15(14)22-2)17-9-18-16(12)19-10-3-5-11(20)6-4-10;/h3-9,20H,1-2H3,(H,17,18,19);1HSynonyms: 4-[(6,7-Dimethoxyquinazolin-4-yl)amino]phenolhydrochloride
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WHI-P154, Inhibitor of epidermal growth factor receptor;Inhibitor of Janus kinase 1;Inhibitor of Janus kinase 2;Inhibitor of Janus kinase 3Cas Number: 211555-04-3 Compound CID: 3795Formula: C16H14BrN3O3 Molecular Weight: 376.2IUPAC Name: 2-bromo-4-[(6,7-dimethoxyquinazolin-4-yl)amino]phenolSMILES: COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=C(C=C3)O)Br)OCInChIKey: CBIAKDAYHRWZCU-UHFFFAOYSA-NInChI: InChI=1S/C16H14BrN3O3/c1-22-14-6-10-12(7-15(14)23-2)18-8-19-16(10)20-9-3-4-13(21)11(17)5-9/h3-8,21H,1-2H3,(H,18,19,20)Synonyms: HB1431 | BCP09619 | SR-02000000171 | 4-(3'-bromo-4'-hydroxyphenyl)amino-6,7-dimethoxyquinazoline | GTPL5993 | 2-Bromo...
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WHI-P97Cas Number: 211555-05-4 Compound CID: 3796Formula: C16H13Br2N3O3 Molecular Weight: 455.11IUPAC Name: 2,6-dibromo-4-[(6,7-dimethoxyquinazolin-4-yl)amino]phenolSMILES: COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=C(C(=C3)Br)O)Br)OCInChIKey: YVCXQRVVNQMZEI-UHFFFAOYSA-NInChI: InChI=1S/C16H13Br2N3O3/c1-23-13-5-9-12(6-14(13)24-2)19-7-20-16(9)21-8-3-10(17)15(22)11(18)4-8/h3-7,22H,1-2H3,(H,19,20,21)Synonyms: HMS3265F24 | 2,6-Dibromo-4-((6,7-dimethoxyquinazolin-4-yl)amino)phenol | 2,6-Dibromo-4-(6,7-dimethoxy-quinazolin-4-yl...
