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canSAR1202494
FEATURES
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NAMES
    SMILES
    Cc1cnc(/C=N/NC(N)=S)c2cccc([N+](=O)[O-])c12
    InChI
    InChI=1S/C12H11N5O2S/c1-7-5-14-9(6-15-16-12(13)20)8-3-2-4-10(11(7)8)17(18)19/h2-6H,1H3,(H3,13,16,20)/b15-6+
    MOLECULAR FORMULA
    C12H11N5O2S
    CROSS REFERENCES
    1202494 logo

    canSAR1202494

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 289.06
    AlogP 1.62
    HBond donors 3
    HBond acceptors 7
    Atoms 31
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1202494.