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Suanfarma Suanfarma

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    Technical details about arzerra, learn more about the structure, uses, toxicity, action, side effects and more

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    arzerra

    APIs // Active Pharmaceutical Ingredients

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    DOSSIERs // Finished Dosage Forms

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    2D Structure
    1. Also known as:
    Molecular Formula
    C12H10N4O2
    Molecular Weight
    242.23  g/mol
    InChI Key
    LZMPYSIUWPEIRA-XFXZXTDPSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (4E)-4-(1,2-oxazol-3-ylidene)-12-oxa-3,5,8-triazatricyclo[7.4.0.02,6]trideca-1(9),2,5,7-tetraene
    2.1.2 InChI
    InChI=1S/C12H10N4O2/c1-3-17-6-7-8(1)13-5-10-11(7)15-12(14-10)9-2-4-18-16-9/h2,4-5,16H,1,3,6H2/b12-9-
    2.1.3 InChI Key
    LZMPYSIUWPEIRA-XFXZXTDPSA-N
    2.1.4 Canonical SMILES
    C1COCC2=C1N=CC3=NC(=C4C=CON4)N=C23
    2.1.5 Isomeric SMILES
    C1COCC2=C1N=CC3=N/C(=C/4\C=CON4)/N=C23
    2.2 Create Date
    2006-07-28
    3 Chemical and Physical Properties
    Molecular Weight 242.23 g/mol
    Molecular Formula C12H10N4O2
    XLogP3-0.3
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count6
    Rotatable Bond Count0
    Exact Mass242.08037557 g/mol
    Monoisotopic Mass242.08037557 g/mol
    Topological Polar Surface Area67.6 A^2
    Heavy Atom Count18
    Formal Charge0
    Complexity608
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count1
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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