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canSAR109509
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NAMES
    SMILES
    CN(C)Cc1cccc(CSCCNc2n[s+]([O-])nc2N)n1
    InChI
    InChI=1S/C13H20N6OS2/c1-19(2)8-10-4-3-5-11(16-10)9-21-7-6-15-13-12(14)17-22(20)18-13/h3-5H,6-9H2,1-2H3,(H2,14,17)(H,15,18)
    MOLECULAR FORMULA
    C13H20N6OS2
    CROSS REFERENCES
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    canSAR109509

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 340.11
    AlogP 1.59
    HBond donors 3
    HBond acceptors 7
    Atoms 42
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR109509.