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canSAR1954940
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NAMES
    SMILES
    c1nc(-c2nc3ccc(C4=[NH+]CCN4)cc3[nH]2)c[nH]1
    InChI
    InChI=1S/C13H10N6/c1-2-9-10(5-8(1)12-15-3-4-16-12)19-13(18-9)11-6-14-7-17-11/h1-2,5-7H,3-4H2,(H,15,16)/p+1/b13-11-
    MOLECULAR FORMULA
    C13H13N6+
    CROSS REFERENCES
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    canSAR1954940

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 253.12
    AlogP -0.62
    HBond donors 4
    HBond acceptors 6
    Atoms 32
    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 canSAR1954940.