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canSAR1265130
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NAMES
    SMILES
    Cc1cc(C#N)cc(C)c1Oc1cc(Nc2ccc(C#N)cc2)nc2ncnn12
    InChI
    InChI=1S/C21H15N7O/c1-13-7-16(11-23)8-14(2)20(13)29-19-9-18(27-21-24-12-25-28(19)21)26-17-5-3-15(10-22)4-6-17/h3-9,12H,1-2H3,(H,24,25,26,27)
    MOLECULAR FORMULA
    C21H15N7O
    CROSS REFERENCES
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    canSAR1265130

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 381.13
    AlogP 4.02
    HBond donors 1
    HBond acceptors 8
    Atoms 44
    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 canSAR1265130.