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canSAR1637884
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NAMES
    SMILES
    COc1ccc(CNc2nc3ccccc3n2C)c(O)c1
    InChI
    InChI=1S/C16H17N3O2/c1-19-14-6-4-3-5-13(14)18-16(19)17-10-11-7-8-12(21-2)9-15(11)20/h3-9,20H,10H2,1-2H3,(H,17,18)
    MOLECULAR FORMULA
    C16H17N3O2
    CROSS REFERENCES
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    canSAR1637884

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 283.13
    AlogP 2.90
    HBond donors 2
    HBond acceptors 5
    Atoms 38
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1637884.