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Aicardi syndrome (DOID:8461)

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  1. PKI-402
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    PKI-402
    CAS: 1173204-81-3 Formula: C29H34N10O3 Molecular Weight: 570.65
    Solid ≥98%
    Out of Stock Item #: P127674
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    Technical Identifiers
    IUPAC Name
    1-[4-(3-ethyl-7-morpholin-4-yltriazolo[4,5-d]pyrimidin-5-yl)phenyl]-3-[4-(4-methylpiperazine-1-carbonyl)phenyl]urea
    SMILES
    CCN1C2=C(C(=NC(=N2)C3=CC=C(C=C3)NC(=O)NC4=CC=C(C=C4)C(=O)N5CCN(CC5)C)N6CCOCC6)N=N1
    InChIKey
    ZAXFYGBKZSQBIV-UHFFFAOYSA-N
    InChI
    1S/C29H34N10O3/c1-3-39-27-24(34-35-39)26(37-16-18-42-19-17-37)32-25(33-27)20-4-8-22(9-5-20)30-29(41)31-23-10-6-21(7-11-23)28(40)38-14-12-36(2)13-15-38show more
    Synonyms
    BDBM50308767 | MS-30305 | STL453648 | PKI402 | N-(4-(3-Ethyl-7-(4-morpholinyl)-3H-1,2,3-triazolo(4,5-d)pyrimidin-5-yl...
  2. Nocodazole
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    Nocodazole
    CAS: 31430-18-9 EC Number: 250-626-5 Formula: C14H11N3O3S Molecular Weight: 301.32
    ≥98%
    In Stock Item #: N129755
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    IUPAC Name
    methyl N-[6-(thiophene-2-carbonyl)-1H-benzimidazol-2-yl]carbamate
    SMILES
    COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=CS3
    InChIKey
    KYRVNWMVYQXFEU-UHFFFAOYSA-N
    InChI
    1S/C14H11N3O3S/c1-20-14(19)17-13-15-9-5-4-8(7-10(9)16-13)12(18)11-3-2-6-21-11/h2-7H,1H3,(H2,15,16,17,19)
    Synonyms
    HMS587E01 | Methyl (5-(2-thienylcarbonyl))-1H-benzimidazole-2-ylcarbamate | MLS001164242 | DTXCID7011800 | KBio3_0027...
  3. INK 128 (MLN0128), Serine/threonine-protein kinase mTOR inhibitor
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    INK 128 (MLN0128), Serine/threonine-protein kinase mTOR inhibitor
    CAS: 1224844-38-5 Formula: C15H15N7O Molecular Weight: 309.33
    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 Item #: I128086
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    IUPAC Name
    5-(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)-1,3-benzoxazol-2-amine
    SMILES
    CC(C)N1C2=NC=NC(=C2C(=N1)C3=CC4=C(C=C3)OC(=N4)N)N
    InChIKey
    GYLDXIAOMVERTK-UHFFFAOYSA-N
    InChI
    1S/C15H15N7O/c1-7(2)22-14-11(13(16)18-6-19-14)12(21-22)8-3-4-10-9(5-8)20-15(17)23-10/h3-7H,1-2H3,(H2,17,20)(H2,16,18,19)
    Synonyms
    2-Benzoxazolamine, 5-(4-amino-1-(1-methylethyl)-1H-pyrazolo(3,4-d)pyrimidin-3-yl)- | 3-(2-aminobenzo[d]oxazol-5-yl)-1...
  4. WYE-354, Inhibitor of mechanistic target of rapamycin kinase
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    WYE-354, Inhibitor of mechanistic target of rapamycin kinase
    CAS: 1062169-56-5 PubChem CID: 44219749 Formula: C24H29N7O5 Molecular Weight: 495.54
    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 Item #: W128007
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    IUPAC Name
    methyl 4-[6-[4-(methoxycarbonylamino)phenyl]-4-morpholin-4-ylpyrazolo[3,4-d]pyrimidin-1-yl]piperidine-1-carboxylate
    SMILES
    COC(=O)NC1=CC=C(C=C1)C2=NC3=C(C=NN3C4CCN(CC4)C(=O)OC)C(=N2)N5CCOCC5
    InChIKey
    IMXHGCRIEAKIBU-UHFFFAOYSA-N
    InChI
    1S/C24H29N7O5/c1-34-23(32)26-17-5-3-16(4-6-17)20-27-21(29-11-13-36-14-12-29)19-15-25-31(22(19)28-20)18-7-9-30(10-8-18)24(33)35-2/h3-6,15,18H,7-14H2,1-show more
    Synonyms
    1062169-56-5 | J-514253 | WYE354 | WYE-354 | HMS3654N09 | FT-0675866 | S1266 | AS-55957 | MFCD00008199 | NCGC00242484...
  5. XE-991, Inhibitor of K v7.1;Inhibitor of K v7.2;Inhibitor of K v7.4;Inhibitor of K v7.5
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    XE-991, Inhibitor of K v7.1;Inhibitor of K v7.2;Inhibitor of K v7.4;Inhibitor of K v7.5
    CAS: 122955-42-4 EC Number: 687-389-6 PubChem CID: 45073462 Formula: C26H20N2O Molecular Weight: 376.45
    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 Item #: X335126
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    IUPAC Name
    10,10-bis(pyridin-4-ylmethyl)anthracen-9-one;dihydrochloride
    SMILES
    C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3C2(CC4=CC=NC=C4)CC5=CC=NC=C5.Cl.Cl
    InChIKey
    WOGWMARIFDNZON-UHFFFAOYSA-N
    InChI
    1S/C26H20N2O.2ClH/c29-25-21-5-1-3-7-23(21)26(17-19-9-13-27-14-10-19,18-20-11-15-28-16-12-20)24-8-4-2-6-22(24)25;;/h1-16H,17-18H2;2*1H
    Synonyms
    XE 991 | SR-01000597960-1 | XE 991 dihydrochloride | s2967 | XE991Dihydrochloride | 10,10-bis(pyridin-4-ylmethyl)anth...
  6. A66
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    A66
    CAS: 1166227-08-2 PubChem CID: 42636535 Formula: C17H23N5O2S2 Molecular Weight: 393.53
    ≥98%
    In Stock Item #: A128051
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    IUPAC Name
    (2S)-1-N-[5-(2-tert-butyl-1,3-thiazol-4-yl)-4-methyl-1,3-thiazol-2-yl]pyrrolidine-1,2-dicarboxamide
    SMILES
    CC1=C(SC(=N1)NC(=O)N2CCCC2C(=O)N)C3=CSC(=N3)C(C)(C)C
    InChIKey
    HBPXWEPKNBHKAX-NSHDSACASA-N
    InChI
    1S/C17H23N5O2S2/c1-9-12(10-8-25-14(20-10)17(2,3)4)26-15(19-9)21-16(24)22-7-5-6-11(22)13(18)23/h8,11H,5-7H2,1-4H3,(H2,18,23)(H,19,21,24)/t11-/m0/s1
    Synonyms
    AKOS025293511 | BDBM50042922 | CHEBI:91449 | C71541 | SMR004702785 | s2636 | SCHEMBL14833311 | A66, >=98% (HPLC) | BA...
  7. BYL719, PI3-kinase p110-alpha subunit inhibitor
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    BYL719, PI3-kinase p110-alpha subunit inhibitor
    CAS: 1217486-61-7 EC Number: 806-598-7 Formula: C19H22F3N5O2S Molecular Weight: 441.47
    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 Item #: B127311
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    IUPAC Name
    (2S)-1-N-[4-methyl-5-[2-(1,1,1-trifluoro-2-methylpropan-2-yl)pyridin-4-yl]-1,3-thiazol-2-yl]pyrrolidine-1,2-dicarboxamide
    SMILES
    CC1=C(SC(=N1)NC(=O)N2CCCC2C(=O)N)C3=CC(=NC=C3)C(C)(C)C(F)(F)F
    InChIKey
    STUWGJZDJHPWGZ-LBPRGKRZSA-N
    InChI
    1S/C19H22F3N5O2S/c1-10-14(11-6-7-24-13(9-11)18(2,3)19(20,21)22)30-16(25-10)26-17(29)27-8-4-5-12(27)15(23)28/h6-7,9,12H,4-5,8H2,1-3H3,(H2,23,28)(H,25,2show more
    Synonyms
    (2s)-N~1~-{4-Methyl-5-[2-(1,1,1-Trifluoro-2-Methylpropan-2-Yl)pyridin-4-Yl]-1,3-Thiazol-2-Yl}pyrrolidine-1,2-Dicarbox...
  8. ETP-46464
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    ETP-46464
    CAS: 1345675-02-6 Formula: C30H22N4O2 Molecular Weight: 470.52
    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%
    Out of Stock Item #: E125288
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    IUPAC Name
    2-methyl-2-[4-(2-oxo-9-quinolin-3-yl-4H-[1,3]oxazino[5,4-c]quinolin-1-yl)phenyl]propanenitrile
    SMILES
    CC(C)(C#N)C1=CC=C(C=C1)N2C3=C4C=C(C=CC4=NC=C3COC2=O)C5=CC6=CC=CC=C6N=C5
    InChIKey
    DPLMXAYKJZOTKO-UHFFFAOYSA-N
    InChI
    1S/C30H22N4O2/c1-30(2,18-31)23-8-10-24(11-9-23)34-28-22(17-36-29(34)35)16-33-27-12-7-19(14-25(27)28)21-13-20-5-3-4-6-26(20)32-15-21/h3-16H,17H2,1-2H3
    Synonyms
    2-Methyl-2-[4-(2-oxo-9-quinolin-3-yl-4H-[1,3]oxazino[5,4-c]quinolin-1-yl)phenyl]propanenitrile | 4-[4-(1-Isocyano-1-m...
  9. GDC-0349, Serine/threonine-protein kinase mTOR inhibitor
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    GDC-0349, Serine/threonine-protein kinase mTOR inhibitor
    CAS: 1207360-89-1 Formula: C24H32N6O3 Molecular Weight: 452.55
    ≥99%
    In Stock Item #: G128080
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    Technical Identifiers
    IUPAC Name
    1-ethyl-3-[4-[4-[(3S)-3-methylmorpholin-4-yl]-7-(oxetan-3-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-yl]phenyl]urea
    SMILES
    CCNC(=O)NC1=CC=C(C=C1)C2=NC3=C(CCN(C3)C4COC4)C(=N2)N5CCOCC5C
    InChIKey
    RGJOJUGRHPQXGF-INIZCTEOSA-N
    InChI
    1S/C24H32N6O3/c1-3-25-24(31)26-18-6-4-17(5-7-18)22-27-21-12-29(19-14-33-15-19)9-8-20(21)23(28-22)30-10-11-32-13-16(30)2/h4-7,16,19H,3,8-15H2,1-2H3,(H2show more
    Synonyms
    579255I6O9 | EX-A2248 | Q27261488 | UNII-579255I6O9 | MLS006011173 | NSC780878 | NSC-780878 | (S)-1-ethyl-3-(4-(4-(3-...
  10. Thapsigargin
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    Thapsigargin
    CAS: 67526-95-8 EC Number: 614-076-3 PubChem CID: 446378 Formula: C34H50O12 Molecular Weight: 650.75
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥95%
    In Stock Item #: T135258
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    IUPAC Name
    [(3S,3aR,4S,6S,6aR,7S,8S,9bS)-6-acetyloxy-4-butanoyloxy-3,3a-dihydroxy-3,6,9-trimethyl-8-[(Z)-2-methylbut-2-enoyl]oxy-2-oxo-4,5,6a,7,8,9b-hexahydroazushow more
    SMILES
    CCCCCCCC(=O)OC1C2C(=C(C1OC(=O)C(=CC)C)C)C3C(C(CC2(C)OC(=O)C)OC(=O)CCC)(C(C(=O)O3)(C)O)O
    InChIKey
    IXFPJGBNCFXKPI-FSIHEZPISA-N
    InChI
    1S/C34H50O12/c1-9-12-13-14-15-17-24(37)43-28-26-25(20(5)27(28)44-30(38)19(4)11-3)29-34(41,33(8,40)31(39)45-29)22(42-23(36)16-10-2)18-32(26,7)46-21(6)3show more
    Synonyms
    (-)-Thapsigargin | NCGC00162381-06 | Octanoic Acid [3s-[3alpha, 3abeta, 4alpha,6beta, 6abeta, 7beta, 8alpha(Z), 9balp...
  11. 4'-Butyl-[1,1'-biphenyl]-4-carboxylic acid
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    4'-Butyl-[1,1'-biphenyl]-4-carboxylic acid
    CAS: 59662-46-3 Formula: C17H18O2 Molecular Weight: 254.32
    ≥98%
    In Stock Item #: B194114
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    Technical Identifiers
    IUPAC Name
    4-(4-butylphenyl)benzoic acid
    SMILES
    CCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O
    InChIKey
    BVBTVBVHIQDKKW-UHFFFAOYSA-N
    InChI
    1S/C17H18O2/c1-2-3-4-13-5-7-14(8-6-13)15-9-11-16(12-10-15)17(18)19/h5-12H,2-4H2,1H3,(H,18,19)
    Synonyms
    BVBTVBVHIQDKKW-UHFFFAOYSA-N | FT-0640621 | A869156 | 4-(4-n-Butylphenyl)benzoic acid | 4'-Butyl-[1,1'-biphenyl]-4-car...
  12. AGN 193109, Antagonist of Retinoic acid receptor-α;Antagonist of Retinoic acid receptor-β;Antagonist of Retinoic acid receptor-γ
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    AGN 193109, Antagonist of Retinoic acid receptor-α;Antagonist of Retinoic acid receptor-β;Antagonist of Retinoic acid receptor-γ
    CAS: 171746-21-7 Formula: C28H24O2 Molecular Weight: 392.49
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%(HPLC)
    In Stock Item #: A286823
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    IUPAC Name
    4-[2-[5,5-dimethyl-8-(4-methylphenyl)-6H-naphthalen-2-yl]ethynyl]benzoic acid
    SMILES
    CC1=CC=C(C=C1)C2=CCC(C3=C2C=C(C=C3)C#CC4=CC=C(C=C4)C(=O)O)(C)C
    InChIKey
    NCEQLLNVRRTCKJ-UHFFFAOYSA-N
    InChI
    1S/C28H24O2/c1-19-4-11-22(12-5-19)24-16-17-28(2,3)26-15-10-21(18-25(24)26)7-6-20-8-13-23(14-9-20)27(29)30/h4-5,8-16,18H,17H2,1-3H3,(H,29,30)
    Synonyms
    4-((5,5-Dimethyl-8-(p-tolyl)-5,6-dihydronaphthalen-2-yl)ethynyl)benzoic acid | AKOS030211125 | (2S,3S)-5-[2-(dimethyl...
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