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canSAR1833291
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NAMES
    SMILES
    O=C(Nc1ccc([C@H]2CNCCO2)c(F)c1)c1cnn(-c2ccc(C(F)(F)F)nc2)c1
    InChI
    InChI=1S/C20H17F4N5O2/c21-16-7-13(1-3-15(16)17-10-25-5-6-31-17)28-19(30)12-8-27-29(11-12)14-2-4-18(26-9-14)20(22,23)24/h1-4,7-9,11,17,25H,5-6,10H2,(H,28,30)/t17-/m1/s1
    MOLECULAR FORMULA
    C20H17F4N5O2
    CROSS REFERENCES
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    canSAR1833291

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 435.13
    AlogP 3.34
    HBond donors 2
    HBond acceptors 7
    Atoms 48
    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 canSAR1833291.