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canSAR674132
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NAMES
    SMILES
    Cc1ccccc1-n1nnnc1CCC(=O)c1ccccc1
    InChI
    InChI=1S/C17H16N4O/c1-13-7-5-6-10-15(13)21-17(18-19-20-21)12-11-16(22)14-8-3-2-4-9-14/h2-10H,11-12H2,1H3
    MOLECULAR FORMULA
    C17H16N4O
    CROSS REFERENCES
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    canSAR674132

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 292.13
    AlogP 2.79
    HBond donors 0
    HBond acceptors 5
    Atoms 38
    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 canSAR674132.