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    Technical details about 6-Mph4, learn more about the structure, uses, toxicity, action, side effects and more

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    6-Mph4

    APIs // Active Pharmaceutical Ingredients

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    Minakem offers CDMO services for API & HPAPI, generics, regulatory expertise, track record performance & FDA & GMP certifications.

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    2D Structure
    1. Also known as:
    Molecular Formula
    C7H13Cl2N5O
    Molecular Weight
    254.11  g/mol
    InChI Key
    MKQLORLCFAZASZ-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    2-amino-6-methyl-5,6,7,8-tetrahydro-1H-pteridin-4-one;dihydrochloride
    2.1.2 InChI
    InChI=1S/C7H11N5O.2ClH/c1-3-2-9-5-4(10-3)6(13)12-7(8)11-5;;/h3,10H,2H2,1H3,(H4,8,9,11,12,13);2*1H
    2.1.3 InChI Key
    MKQLORLCFAZASZ-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC1CNC2=C(N1)C(=O)N=C(N2)N.Cl.Cl
    2.1.5 Isomeric SMILES
    CC1CNC2=C(N1)C(=O)N=C(N2)N.Cl.Cl
    2.2 Create Date
    2007-07-16
    3 Chemical and Physical Properties
    Molecular Weight 254.11 g/mol
    Molecular Formula C7H13Cl2N5O
    Hydrogen Bond Donor Count6
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count0
    Exact Mass253.0497154 g/mol
    Monoisotopic Mass253.0497154 g/mol
    Topological Polar Surface Area91.5 A^2
    Heavy Atom Count15
    Formal Charge0
    Complexity319
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count3
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