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canSAR1012584
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NAMES
    SMILES
    COc1cc(C)c2nc3[nH]nc(C)c3c(CN3CCCOCC3)c2c1
    InChI
    InChI=1S/C19H24N4O2/c1-12-9-14(24-3)10-15-16(11-23-5-4-7-25-8-6-23)17-13(2)21-22-19(17)20-18(12)15/h9-10H,4-8,11H2,1-3H3,(H,20,21,22)
    MOLECULAR FORMULA
    C19H24N4O2
    CROSS REFERENCES
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    canSAR1012584

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 340.19
    AlogP 2.96
    HBond donors 1
    HBond acceptors 6
    Atoms 49
    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 canSAR1012584.