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canSAR1691339
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NAMES
    SMILES
    COc1cc(Oc2c(C3CCC3)ccc(-c3cnc(N)cn3)c2F)nc(N)n1
    InChI
    InChI=1S/C19H19FN6O2/c1-27-15-7-16(26-19(22)25-15)28-18-11(10-3-2-4-10)5-6-12(17(18)20)13-8-24-14(21)9-23-13/h5-10H,2-4H2,1H3,(H2,21,24)(H2,22,25,26)
    MOLECULAR FORMULA
    C19H19FN6O2
    CROSS REFERENCES
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    canSAR1691339

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 382.16
    AlogP 3.31
    HBond donors 4
    HBond acceptors 8
    Atoms 47
    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 canSAR1691339.