Isocitrate Dehydrogenase (IDH)

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  1. Enasidenib, Inhibitor of isocitrate dehydrogenase (NADP(+)) 2
    CAS: 1446502-11-9 EC Number: 107-597-8 Formula: C19H17F6N7O Molecular Weight: 473.4
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥97%
    ● In Stock — US warehouse, ships to EU* Item #: E174257
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    IUPAC Name
    2-methyl-1-[[4-[6-(trifluoromethyl)pyridin-2-yl]-6-[[2-(trifluoromethyl)pyridin-4-yl]amino]-1,3,5-triazin-2-yl]amino]propan-2-ol
    SMILES
    CC(C)(CNC1=NC(=NC(=N1)C2=NC(=CC=C2)C(F)(F)F)NC3=CC(=NC=C3)C(F)(F)F)O
    InChIKey
    DYLUUSLLRIQKOE-UHFFFAOYSA-N
    InChI
    1S/C19H17F6N7O/c1-17(2,33)9-27-15-30-14(11-4-3-5-12(29-11)18(20,21)22)31-16(32-15)28-10-6-7-26-13(8-10)19(23,24)25/h3-8,33H,9H2,1-2H3,(H2,26,27,28,30,show more
    Synonyms
    1802003-09-3 | Enasidenib [USAN:INN] | IDHIFA | SCHEMBL15102202 | 2-methyl-1-[[4-[6-(trifluoromethyl)pyridin-2-yl]-6-...
  2. AG-120, Isocitrate dehydrogenase [NADP] cytoplasmic inhibitor
    CAS: 1448347-49-6 Formula: C28H22ClF3N6O3 Molecular Weight: 582.96
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    ● In Stock — US warehouse, ships to EU* Item #: A302896
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    IUPAC Name
    (2S)-N-[(1S)-1-(2-chlorophenyl)-2-[(3,3-difluorocyclobutyl)amino]-2-oxoethyl]-1-(4-cyanopyridin-2-yl)-N-(5-fluoropyridin-3-yl)-5-oxopyrrolidine-2-carbshow more
    SMILES
    C1CC(=O)N(C1C(=O)N(C2=CC(=CN=C2)F)C(C3=CC=CC=C3Cl)C(=O)NC4CC(C4)(F)F)C5=NC=CC(=C5)C#N
    InChIKey
    WIJZXSAJMHAVGX-DHLKQENFSA-N
    InChI
    1S/C28H22ClF3N6O3/c29-21-4-2-1-3-20(21)25(26(40)36-18-11-28(31,32)12-18)37(19-10-17(30)14-34-15-19)27(41)22-5-6-24(39)38(22)23-9-16(13-33)7-8-35-23/h1show more
    Synonyms
    Ivosidenib (USAN/INN) | AC-32624 | US9850277, Compound 176 | (2S)-N-{(1S)-1-(2-chlorophenyl)-2-[(3,3-difluorocyclobut...
  3. TC-E 5008
    CAS: 50405-58-8 PubChem CID: 13590964 Formula: C13H13NO2 Molecular Weight: 215.25
    ◐ .Made to order · 8–12 wks Item #: T288914
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    IUPAC Name
    6-benzyl-1-hydroxy-4-methylpyridin-2-one
    SMILES
    CC1=CC(=O)N(C(=C1)CC2=CC=CC=C2)O
    InChIKey
    AVLZAVSZOAQKRC-UHFFFAOYSA-N
    InChI
    1S/C13H13NO2/c1-10-7-12(14(16)13(15)8-10)9-11-5-3-2-4-6-11/h2-8,16H,9H2,1H3
    Synonyms
    SYC 435 | 1-Hydroxy-4-methyl-6-(phenylmethyl)-2-(1H)pyridinone
  4. AGI-5198, Inhibitor of isocitrate dehydrogenase (NADP(+)) 1
    CAS: 1355326-35-0 EC Number: 806-071-1 Formula: C27H31FN4O2 Molecular Weight: 462.56
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    ● In Stock — US warehouse, ships to EU* Item #: A126546
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    IUPAC Name
    N-cyclohexyl-2-(3-fluoro-N-[2-(2-methylimidazol-1-yl)acetyl]anilino)-2-(2-methylphenyl)acetamide
    SMILES
    CC1=CC=CC=C1C(C(=O)NC2CCCCC2)N(C3=CC(=CC=C3)F)C(=O)CN4C=CN=C4C
    InChIKey
    FNYGWXSATBUBER-UHFFFAOYSA-N
    InChI
    1S/C27H31FN4O2/c1-19-9-6-7-14-24(19)26(27(34)30-22-11-4-3-5-12-22)32(23-13-8-10-21(28)17-23)25(33)18-31-16-15-29-20(31)2/h6-10,13-17,22,26H,3-5,11-12,show more
    Synonyms
    HMS3653K15 | N-cyclohexyl-2-(N-(3-fluorophenyl)-2-(2-methyl-1H-imidazol-1-yl)acetamido)-2-o-tolylacetamide | AKOS0266...
  5. AGI-6780
    CAS: 1432660-47-3 Formula: C21H18F3N3O3S2 Molecular Weight: 481.51
    ● In Stock — US warehouse, ships to EU* Item #: A124933
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    IUPAC Name
    1-[5-(cyclopropylsulfamoyl)-2-thiophen-3-ylphenyl]-3-[3-(trifluoromethyl)phenyl]urea
    SMILES
    C1CC1NS(=O)(=O)C2=CC(=C(C=C2)C3=CSC=C3)NC(=O)NC4=CC=CC(=C4)C(F)(F)F
    InChIKey
    CCAWRGNYALGPQH-UHFFFAOYSA-N
    InChI
    1S/C21H18F3N3O3S2/c22-21(23,24)14-2-1-3-16(10-14)25-20(28)26-19-11-17(32(29,30)27-15-4-5-15)6-7-18(19)13-8-9-31-12-13/h1-3,6-12,15,27H,4-5H2,(H2,25,26show more
    Synonyms
    AC-35210 | AGI 6780 | SW220033-1 | N-cyclopropyl-4-(thiophen-3-yl)-3-(3-(3-(trifluoromethyl)phenyl)ureido)benzenesulf...
  6. Vorasidenib (AG-881), IDH1/IDH2 inhibitor
    CAS: 1644545-52-7 PubChem CID: 117817422 Formula: C14H13ClF6N6 Molecular Weight: 414.74
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    ● In Stock — US warehouse, ships to EU* Item #: V305105
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    IUPAC Name
    6-(6-chloropyridin-2-yl)-2-N,4-N-bis[(2R)-1,1,1-trifluoropropan-2-yl]-1,3,5-triazine-2,4-diamine
    SMILES
    CC(C(F)(F)F)NC1=NC(=NC(=N1)C2=NC(=CC=C2)Cl)NC(C)C(F)(F)F
    InChIKey
    QCZAWDGAVJMPTA-RNFRBKRXSA-N
    InChI
    1S/C14H13ClF6N6/c1-6(13(16,17)18)22-11-25-10(8-4-3-5-9(15)24-8)26-12(27-11)23-7(2)14(19,20)21/h3-7H,1-2H3,(H2,22,23,25,26,27)/t6-,7-/m1/s1
    Synonyms
    6-(6-chloropyridin-2-yl)-2-N,4-N-bis[(2R)-1,1,1-trifluoropropan-2-yl]-1,3,5-triazine-2,4-diamine | AG 881 [WHO-DD] | ...
  7. AG-120 (racemic)
    CAS: 1448346-63-1 Formula: C28H22ClF3N6O3 Molecular Weight: 582.96
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: A421656
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    IUPAC Name
    (2S)-N-[1-(2-chlorophenyl)-2-[(3,3-difluorocyclobutyl)amino]-2-oxoethyl]-1-(4-cyanopyridin-2-yl)-N-(5-fluoropyridin-3-yl)-5-oxopyrrolidine-2-carboxamishow more
    SMILES
    C1CC(=O)N(C1C(=O)N(C2=CC(=CN=C2)F)C(C3=CC=CC=C3Cl)C(=O)NC4CC(C4)(F)F)C5=NC=CC(=C5)C#N
    InChIKey
    WIJZXSAJMHAVGX-XADRRFQNSA-N
    InChI
    1S/C28H22ClF3N6O3/c29-21-4-2-1-3-20(21)25(26(40)36-18-11-28(31,32)12-18)37(19-10-17(30)14-34-15-19)27(41)22-5-6-24(39)38(22)23-9-16(13-33)7-8-35-23/h1show more
    Synonyms
    Glycinamide,1-​(4-​cyano-​2-​pyridinyl)​-​5-​oxo-​L-​prolyl-​2-​(2-​chlorophenyl)​-​N-​(3,​3-​difluorocyclobutyl)​-​N2-...
  8. AG-120 (racemic)
    CAS: 1448346-63-1 Formula: C28H22ClF3N6O3 Molecular Weight: 582.96
    ● In Stock — US warehouse, ships to EU* Item #: A412505
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    Technical Identifiers
    IUPAC Name
    (2S)-N-[1-(2-chlorophenyl)-2-[(3,3-difluorocyclobutyl)amino]-2-oxoethyl]-1-(4-cyanopyridin-2-yl)-N-(5-fluoropyridin-3-yl)-5-oxopyrrolidine-2-carboxamishow more
    SMILES
    C1CC(=O)N(C1C(=O)N(C2=CC(=CN=C2)F)C(C3=CC=CC=C3Cl)C(=O)NC4CC(C4)(F)F)C5=NC=CC(=C5)C#N
    InChIKey
    WIJZXSAJMHAVGX-XADRRFQNSA-N
    InChI
    1S/C28H22ClF3N6O3/c29-21-4-2-1-3-20(21)25(26(40)36-18-11-28(31,32)12-18)37(19-10-17(30)14-34-15-19)27(41)22-5-6-24(39)38(22)23-9-16(13-33)7-8-35-23/h1show more
    Synonyms
    Glycinamide,1-​(4-​cyano-​2-​pyridinyl)​-​5-​oxo-​L-​prolyl-​2-​(2-​chlorophenyl)​-​N-​(3,​3-​difluorocyclobutyl)​-​N2-...
  9. AGI-5198, Inhibitor of isocitrate dehydrogenase (NADP(+)) 1
    CAS: 1355326-35-0 EC Number: 806-071-1 Formula: C27H31FN4O2 Molecular Weight: 462.56
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. 10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: A421351
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    Technical Identifiers
    IUPAC Name
    N-cyclohexyl-2-(3-fluoro-N-[2-(2-methylimidazol-1-yl)acetyl]anilino)-2-(2-methylphenyl)acetamide
    SMILES
    CC1=CC=CC=C1C(C(=O)NC2CCCCC2)N(C3=CC(=CC=C3)F)C(=O)CN4C=CN=C4C
    InChIKey
    FNYGWXSATBUBER-UHFFFAOYSA-N
    InChI
    1S/C27H31FN4O2/c1-19-9-6-7-14-24(19)26(27(34)30-22-11-4-3-5-12-22)32(23-13-8-10-21(28)17-23)25(33)18-31-16-15-29-20(31)2/h6-10,13-17,22,26H,3-5,11-12,show more
    Synonyms
    HMS3653K15 | N-cyclohexyl-2-(N-(3-fluorophenyl)-2-(2-methyl-1H-imidazol-1-yl)acetamido)-2-o-tolylacetamide | AKOS0266...
  10. AGI-6780
    CAS: 1432660-47-3 Formula: C21H18F3N3O3S2 Molecular Weight: 481.51
    10mM in DMSO
    ● In Stock — US warehouse, ships to EU* Item #: A421598
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    Technical Identifiers
    IUPAC Name
    1-[5-(cyclopropylsulfamoyl)-2-thiophen-3-ylphenyl]-3-[3-(trifluoromethyl)phenyl]urea
    SMILES
    C1CC1NS(=O)(=O)C2=CC(=C(C=C2)C3=CSC=C3)NC(=O)NC4=CC=CC(=C4)C(F)(F)F
    InChIKey
    CCAWRGNYALGPQH-UHFFFAOYSA-N
    InChI
    1S/C21H18F3N3O3S2/c22-21(23,24)14-2-1-3-16(10-14)25-20(28)26-19-11-17(32(29,30)27-15-4-5-15)6-7-18(19)13-8-9-31-12-13/h1-3,6-12,15,27H,4-5H2,(H2,25,26show more
    Synonyms
    AC-35210 | AGI 6780 | SW220033-1 | N-cyclopropyl-4-(thiophen-3-yl)-3-(3-(3-(trifluoromethyl)phenyl)ureido)benzenesulf...
  11. BAY 1436032, Isocitrate dehydrogenase [NADP] cytoplasmic inhibitor
    CAS: 1803274-65-8 Formula: C26H30F3N3O3 Molecular Weight: 489.53
    Solid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    ◐ .Made to order · 8–12 wks Item #: B414041
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    IUPAC Name
    3-[2-[4-(trifluoromethoxy)anilino]-1-[(1R,5R)-3,3,5-trimethylcyclohexyl]benzimidazol-5-yl]propanoic acid
    SMILES
    CC1CC(CC(C1)(C)C)N2C3=C(C=C(C=C3)CCC(=O)O)N=C2NC4=CC=C(C=C4)OC(F)(F)F
    InChIKey
    RNMAUIMMNAHKQR-QFBILLFUSA-N
    InChI
    1S/C26H30F3N3O3/c1-16-12-19(15-25(2,3)14-16)32-22-10-4-17(5-11-23(33)34)13-21(22)31-24(32)30-18-6-8-20(9-7-18)35-26(27,28)29/h4,6-10,13,16,19H,5,11-12show more
    Synonyms
    BAY-1436032 | US10344004, Test compound Table 3 | SCHEMBL17009632 | BAY 1436032 | s8530 | 3-(2-((4-(trifluoromethoxy)...
  12. DS-1001b (DS 1001), Isocitrate dehydrogenase [NADP] cytoplasmic inhibitor
    CAS: 1898207-64-1 PubChem CID: 139600317 Formula: C29H29Cl3FN3O4 Molecular Weight: 608.92
    ● In Stock — US warehouse, ships to EU* Item #: D414241
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    IUPAC Name
    (E)-3-[1-[5-(2-fluoropropan-2-yl)-3-(2,4,6-trichlorophenyl)-1,2-oxazole-4-carbonyl]-3-methylindol-4-yl]prop-2-enoic acid;2-methylpropan-2-amine
    SMILES
    CC1=CN(C2=CC=CC(=C12)C=CC(=O)O)C(=O)C3=C(ON=C3C4=C(C=C(C=C4Cl)Cl)Cl)C(C)(C)F.CC(C)(C)N
    InChIKey
    UPPAAWQBZQBNIE-USRGLUTNSA-N
    InChI
    1S/C25H18Cl3FN2O4.C4H11N/c1-12-11-31(17-6-4-5-13(19(12)17)7-8-18(32)33)24(34)21-22(30-35-23(21)25(2,3)29)20-15(27)9-14(26)10-16(20)28;1-4(2,3)5/h4-11Hshow more
    Synonyms
    C29H29Cl3FN3O4 | 2-Methylpropan-2-amine (E)-3-(1-(5-(2-fluoropropan-2-yl)-3-(2,4,6-trichlorophenyl)isoxazole-4-carbon...
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Frequently Asked Questions

What can I find under Isocitrate Dehydrogenase (IDH)?
This listing collects compounds associated with Isocitrate Dehydrogenase (IDH) within our Metabolic Enzyme/Protease area — inhibitors, agonists or antagonists, and reference tool compounds. Each entry links to its structure, CAS number, and reported activity so you can confirm the annotation before ordering.
What should I consider when picking a compound for Isocitrate Dehydrogenase (IDH)?
Consider the reported potency of each Isocitrate Dehydrogenase (IDH) compound and the assay behind it, selectivity against closely related targets, cell permeability if you are working in cells, and stability in your buffer. Two chemically distinct compounds giving the same phenotype is much stronger evidence than one.
What quality information is provided for Isocitrate Dehydrogenase (IDH) compounds?
Each Isocitrate Dehydrogenase (IDH) product page lists purity, identity data, molecular formula and weight, and storage conditions, with a lot-specific Certificate of Analysis available. Solubility and handling notes are on the datasheet. All products are supplied for professional research and development use only, and are not for use in humans, animals, diagnostics, or therapy.
Can I search Isocitrate Dehydrogenase (IDH) compounds by activity or structure?
Yes. Filter the Isocitrate Dehydrogenase (IDH) listing by mechanism — inhibitor, agonist, antagonist — and search by target name or gene symbol, CAS number, molecular formula, or SMILES to reach exact structures and close analogs. For bulk quantities or items not listed, contact [email protected].

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