 | | A1A5E | | Name: | (2S)-2-methyl-3-[(2-oxo-1,2,3,4-tetrahydroquinoline-6-carbonyl)amino]propanoic acid | | Formula: | C14 H16 N2 O4 | | SMILES: | O=C(O)C(C)CNC(=O)c1ccc2NC(=O)CCc2c1 | | InChi: | InChI=1S/C14H16N2O4/c1-8(14(19)20)7-15-13(18)10-2-4-11-9(6-10)3-5-12(17)16-11/h2,4,6,8H,3,5,7H2,1H3,(H,15,18)(H,16,17)(H,19,20)/t8-/m0/s1 | | Definition date: | 2024-09-09 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | (2S)-2-methyl-3-[(2-oxo-1,2,3,4-tetrahydroquinoline-6-carbonyl)amino]propanoic acid |
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 | | A1A5F | | Name: | (2S)-6-methyl-N-[(4S)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl]-3,4-dihydro-2H-1-benzopyran-2-carboxamide | | Formula: | C17 H20 N4 O2 | | SMILES: | Cc1ccc2OC(CCc2c1)C(=O)Nc1nnc2CCCCn21 | | InChi: | InChI=1S/C17H20N4O2/c1-11-5-7-13-12(10-11)6-8-14(23-13)16(22)18-17-20-19-15-4-2-3-9-21(15)17/h5,7,10,14H,2-4,6,8-9H2,1H3,(H,18,20,22)/t14-/m0/s1 | | Definition date: | 2024-09-09 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | (2S)-6-methyl-N-[(4S)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl]-3,4-dihydro-2H-1-benzopyran-2-carboxamide |
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 | | A1A5X | | Name: | 4-fluoro-3-({[1-(propan-2-yl)-1H-tetrazol-5-yl]sulfanyl}methyl)-1-benzothiophene-2-carboxylic acid | | Formula: | C14 H13 F N4 O2 S2 | | SMILES: | CC(C)n1nnnc1SCc1c2c(F)cccc2sc1C(=O)O | | InChi: | InChI=1S/C14H13FN4O2S2/c1-7(2)19-14(16-17-18-19)22-6-8-11-9(15)4-3-5-10(11)23-12(8)13(20)21/h3-5,7H,6H2,1-2H3,(H,20,21) | | Definition date: | 2024-09-10 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | 4-fluoro-3-({[1-(propan-2-yl)-1H-tetrazol-5-yl]sulfanyl}methyl)-1-benzothiophene-2-carboxylic acid |
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 | | A1A5Y | | Name: | (8R)-6-(7-fluoro-2-oxo-1,2,3,4-tetrahydroquinoline-6-carbonyl)-6-azaspiro[4.5]decane-8-carboxylic acid | | Formula: | C20 H23 F N2 O4 | | SMILES: | O=C1CCc2cc(c(F)cc2N1)C(=O)N1CC(CCC21CCCC2)C(=O)O | | InChi: | InChI=1S/C20H23FN2O4/c21-15-10-16-12(3-4-17(24)22-16)9-14(15)18(25)23-11-13(19(26)27)5-8-20(23)6-1-2-7-20/h9-10,13H,1-8,11H2,(H,22,24)(H,26,27)/t13-/m1/s1 | | Definition date: | 2024-09-10 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | (8R)-6-(7-fluoro-2-oxo-1,2,3,4-tetrahydroquinoline-6-carbonyl)-6-azaspiro[4.5]decane-8-carboxylic acid |
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 | | A1A6U | | Name: | (1R)-1-[(2R)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrrolidin-2-yl]ethane-1,2-diol | | Formula: | C12 H16 N4 O2 | | SMILES: | OCC(O)C1CCCN1c1ncnc2[NH]ccc12 | | InChi: | InChI=1S/C12H16N4O2/c17-6-10(18)9-2-1-5-16(9)12-8-3-4-13-11(8)14-7-15-12/h3-4,7,9-10,17-18H,1-2,5-6H2,(H,13,14,15)/t9-,10+/m1/s1 | | Definition date: | 2024-09-16 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | (1R)-1-[(2R)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrrolidin-2-yl]ethane-1,2-diol |
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 | | A1A6Y | | Name: | (2S)-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-3-(1,3-thiazol-5-yl)propan-1-ol | | Formula: | C12 H13 N5 O S | | SMILES: | OCC(Nc1ncnc2[NH]ccc12)Cc1cncs1 | | InChi: | InChI=1S/C12H13N5OS/c18-5-8(3-9-4-13-7-19-9)17-12-10-1-2-14-11(10)15-6-16-12/h1-2,4,6-8,18H,3,5H2,(H2,14,15,16,17)/t8-/m0/s1 | | Definition date: | 2024-09-16 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | (2S)-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-3-(1,3-thiazol-5-yl)propan-1-ol |
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 | | A1A6Z | | Name: | [(2S)-4,4-dimethyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrrolidin-2-yl]methanol | | Formula: | C13 H18 N4 O | | SMILES: | OCC1CC(C)(C)CN1c1ncnc2[NH]ccc12 | | InChi: | InChI=1S/C13H18N4O/c1-13(2)5-9(6-18)17(7-13)12-10-3-4-14-11(10)15-8-16-12/h3-4,8-9,18H,5-7H2,1-2H3,(H,14,15,16)/t9-/m0/s1 | | Definition date: | 2024-09-16 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | [(2S)-4,4-dimethyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrrolidin-2-yl]methanol |
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 | | A1A76 | | Name: | [(2S,3aS,6aS)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)octahydrocyclopenta[b]pyrrol-2-yl]methanol | | Formula: | C14 H18 N4 O | | SMILES: | OCC1CC2CCCC2N1c1ncnc2[NH]ccc12 | | InChi: | InChI=1S/C14H18N4O/c19-7-10-6-9-2-1-3-12(9)18(10)14-11-4-5-15-13(11)16-8-17-14/h4-5,8-10,12,19H,1-3,6-7H2,(H,15,16,17)/t9-,10-,12-/m0/s1 | | Definition date: | 2024-09-18 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | [(2S,3aS,6aS)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)octahydrocyclopenta[b]pyrrol-2-yl]methanol |
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 | | A1A77 | | Name: | [(2R)-4-methyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperazin-2-yl]methanol | | Formula: | C12 H17 N5 O | | SMILES: | CN1CC(CO)N(CC1)c1ncnc2[NH]ccc12 | | InChi: | InChI=1S/C12H17N5O/c1-16-4-5-17(9(6-16)7-18)12-10-2-3-13-11(10)14-8-15-12/h2-3,8-9,18H,4-7H2,1H3,(H,13,14,15)/t9-/m1/s1 | | Definition date: | 2024-09-18 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | [(2R)-4-methyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperazin-2-yl]methanol |
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 | | A1A78 | | Name: | [(2S,4R)-4-tert-butyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-2-yl]methanol | | Formula: | C16 H24 N4 O | | SMILES: | CC(C)(C)C1CC(CO)N(CC1)c1ncnc2[NH]ccc12 | | InChi: | InChI=1S/C16H24N4O/c1-16(2,3)11-5-7-20(12(8-11)9-21)15-13-4-6-17-14(13)18-10-19-15/h4,6,10-12,21H,5,7-9H2,1-3H3,(H,17,18,19)/t11-,12+/m1/s1 | | Definition date: | 2024-09-18 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | [(2S,4R)-4-tert-butyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-2-yl]methanol |
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 | | A1A7Z | | Name: | (2S)-2-phenyl-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]ethan-1-ol | | Formula: | C14 H14 N4 O | | SMILES: | OCC(Nc1ncnc2[NH]ccc21)c1ccccc1 | | InChi: | InChI=1S/C14H14N4O/c19-8-12(10-4-2-1-3-5-10)18-14-11-6-7-15-13(11)16-9-17-14/h1-7,9,12,19H,8H2,(H2,15,16,17,18)/t12-/m1/s1 | | Definition date: | 2024-09-18 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | (2S)-2-phenyl-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]ethan-1-ol |
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 | | A1A88 | | Name: | (2S)-3-(1H-indol-3-yl)-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]propan-1-ol | | Formula: | C17 H17 N5 O | | SMILES: | OCC(Cc1c[NH]c2ccccc21)Nc1ncnc2[NH]ccc21 | | InChi: | InChI=1S/C17H17N5O/c23-9-12(7-11-8-19-15-4-2-1-3-13(11)15)22-17-14-5-6-18-16(14)20-10-21-17/h1-6,8,10,12,19,23H,7,9H2,(H2,18,20,21,22)/t12-/m0/s1 | | Definition date: | 2024-09-22 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | (2S)-3-(1H-indol-3-yl)-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]propan-1-ol |
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 | | A1A89 | | Name: | (2S)-2-cyclopropyl-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]ethan-1-ol | | Formula: | C11 H14 N4 O | | SMILES: | OCC(Nc1ncnc2[NH]ccc21)C1CC1 | | InChi: | InChI=1S/C11H14N4O/c16-5-9(7-1-2-7)15-11-8-3-4-12-10(8)13-6-14-11/h3-4,6-7,9,16H,1-2,5H2,(H2,12,13,14,15)/t9-/m1/s1 | | Definition date: | 2024-09-22 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | (2S)-2-cyclopropyl-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]ethan-1-ol |
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 | | A1A8E | | Name: | [(2S)-5,5-dimethyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-2-yl]methanol | | Formula: | C14 H20 N4 O | | SMILES: | OCC1CCC(C)(C)CN1c1ncnc2[NH]ccc12 | | InChi: | InChI=1S/C14H20N4O/c1-14(2)5-3-10(7-19)18(8-14)13-11-4-6-15-12(11)16-9-17-13/h4,6,9-10,19H,3,5,7-8H2,1-2H3,(H,15,16,17)/t10-/m0/s1 | | Definition date: | 2024-09-19 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | [(2S)-5,5-dimethyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-2-yl]methanol |
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 | | A1A8F | | Name: | [(2R)-5,5-dimethyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-2-yl]methanol | | Formula: | C14 H20 N4 O | | SMILES: | OCC1CCC(C)(C)CN1c1ncnc2[NH]ccc12 | | InChi: | InChI=1S/C14H20N4O/c1-14(2)5-3-10(7-19)18(8-14)13-11-4-6-15-12(11)16-9-17-13/h4,6,9-10,19H,3,5,7-8H2,1-2H3,(H,15,16,17)/t10-/m1/s1 | | Definition date: | 2024-09-19 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | [(2R)-5,5-dimethyl-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-2-yl]methanol |
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 | | A1A8W | | Name: | (2S)-2-cyclobutyl-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]ethan-1-ol | | Formula: | C12 H16 N4 O | | SMILES: | OCC(Nc1ncnc2[NH]ccc21)C1CCC1 | | InChi: | InChI=1S/C12H16N4O/c17-6-10(8-2-1-3-8)16-12-9-4-5-13-11(9)14-7-15-12/h4-5,7-8,10,17H,1-3,6H2,(H2,13,14,15,16)/t10-/m1/s1 | | Definition date: | 2024-09-21 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | (2S)-2-cyclobutyl-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]ethan-1-ol |
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 | | A1A8Z | | Name: | (2R)-3-(4-fluorophenyl)-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]propan-1-ol | | Formula: | C15 H15 F N4 O | | SMILES: | Fc1ccc(cc1)CC(CO)Nc1ncnc2[NH]ccc21 | | InChi: | InChI=1S/C15H15FN4O/c16-11-3-1-10(2-4-11)7-12(8-21)20-15-13-5-6-17-14(13)18-9-19-15/h1-6,9,12,21H,7-8H2,(H2,17,18,19,20)/t12-/m1/s1 | | Definition date: | 2024-09-21 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | (2R)-3-(4-fluorophenyl)-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]propan-1-ol |
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 | | A1A9A | | Name: | (R)-phenyl[(2R)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrrolidin-2-yl]methanol | | Formula: | C17 H18 N4 O | | SMILES: | OC(C1CCCN1c1ncnc2[NH]ccc12)c1ccccc1 | | InChi: | InChI=1S/C17H18N4O/c22-15(12-5-2-1-3-6-12)14-7-4-10-21(14)17-13-8-9-18-16(13)19-11-20-17/h1-3,5-6,8-9,11,14-15,22H,4,7,10H2,(H,18,19,20)/t14-,15-/m1/s1 | | Definition date: | 2024-09-22 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | (R)-phenyl[(2R)-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrrolidin-2-yl]methanol |
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 | | A1A9E | | Name: | [(2R,4R)-4-methoxy-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrrolidin-2-yl]methanol | | Formula: | C12 H16 N4 O2 | | SMILES: | OCC1CC(CN1c1ncnc2[NH]ccc12)OC | | InChi: | InChI=1S/C12H16N4O2/c1-18-9-4-8(6-17)16(5-9)12-10-2-3-13-11(10)14-7-15-12/h2-3,7-9,17H,4-6H2,1H3,(H,13,14,15)/t8-,9-/m1/s1 | | Definition date: | 2024-09-23 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | [(2R,4R)-4-methoxy-1-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrrolidin-2-yl]methanol |
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 | | A1A9F | | Name: | (2S)-3-(1-methyl-1H-pyrazol-4-yl)-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]propan-1-ol | | Formula: | C13 H16 N6 O | | SMILES: | Cn1cc(CC(Nc2ncnc3[NH]ccc32)CO)cn1 | | InChi: | InChI=1S/C13H16N6O/c1-19-6-9(5-17-19)4-10(7-20)18-13-11-2-3-14-12(11)15-8-16-13/h2-3,5-6,8,10,20H,4,7H2,1H3,(H2,14,15,16,18)/t10-/m0/s1 | | Definition date: | 2024-09-23 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | (2S)-3-(1-methyl-1H-pyrazol-4-yl)-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]propan-1-ol |
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 | | A1A9Q | | Name: | (2S)-3-(dimethylamino)-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]propan-1-ol | | Formula: | C11 H17 N5 O | | SMILES: | CN(C)CC(CO)Nc1ncnc2[NH]ccc21 | | InChi: | InChI=1S/C11H17N5O/c1-16(2)5-8(6-17)15-11-9-3-4-12-10(9)13-7-14-11/h3-4,7-8,17H,5-6H2,1-2H3,(H2,12,13,14,15)/t8-/m0/s1 | | Definition date: | 2024-09-24 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | (2S)-3-(dimethylamino)-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]propan-1-ol |
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 | | A1A9U | | Name: | (2R)-3-(3-methylphenyl)-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]propan-1-ol | | Formula: | C16 H18 N4 O | | SMILES: | Cc1cccc(c1)CC(CO)Nc1ncnc2[NH]ccc21 | | InChi: | InChI=1S/C16H18N4O/c1-11-3-2-4-12(7-11)8-13(9-21)20-16-14-5-6-17-15(14)18-10-19-16/h2-7,10,13,21H,8-9H2,1H3,(H2,17,18,19,20)/t13-/m1/s1 | | Definition date: | 2024-09-24 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | (2R)-3-(3-methylphenyl)-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]propan-1-ol |
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 | | A1A9V | | Name: | (2S)-3-(piperidin-1-yl)-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]propan-1-ol | | Formula: | C14 H21 N5 O | | SMILES: | OCC(Nc1ncnc2[NH]ccc21)CN1CCCCC1 | | InChi: | InChI=1S/C14H21N5O/c20-9-11(8-19-6-2-1-3-7-19)18-14-12-4-5-15-13(12)16-10-17-14/h4-5,10-11,20H,1-3,6-9H2,(H2,15,16,17,18)/t11-/m0/s1 | | Definition date: | 2024-09-24 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | (2S)-3-(piperidin-1-yl)-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]propan-1-ol |
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 | | A1A9Y | | Name: | (2R)-3-(4-methylphenyl)-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]propan-1-ol | | Formula: | C16 H18 N4 O | | SMILES: | Cc1ccc(cc1)CC(CO)Nc1ncnc2[NH]ccc21 | | InChi: | InChI=1S/C16H18N4O/c1-11-2-4-12(5-3-11)8-13(9-21)20-16-14-6-7-17-15(14)18-10-19-16/h2-7,10,13,21H,8-9H2,1H3,(H2,17,18,19,20)/t13-/m1/s1 | | Definition date: | 2024-09-24 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | (2R)-3-(4-methylphenyl)-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]propan-1-ol |
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 | | A1A9Z | | Name: | (2S)-3-(4-methylphenyl)-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]propan-1-ol | | Formula: | C16 H18 N4 O | | SMILES: | Cc1ccc(cc1)CC(CO)Nc1ncnc2[NH]ccc21 | | InChi: | InChI=1S/C16H18N4O/c1-11-2-4-12(5-3-11)8-13(9-21)20-16-14-6-7-17-15(14)18-10-19-16/h2-7,10,13,21H,8-9H2,1H3,(H2,17,18,19,20)/t13-/m0/s1 | | Definition date: | 2024-09-24 | | Last modified: | 2025-06-06 | | Release date: | 2025-06-11 | | Identifier: | (2S)-3-(4-methylphenyl)-2-[(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]propan-1-ol |
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