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canSAR842232
FEATURES
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NAMES
    SMILES
    CCO/N=C1\CN(c2c(F)cc3c(=O)c(C(=O)O)cn(CCF)c3c2F)CC1/C(N)=N\O
    InChI
    InChI=1S/C19H20F3N5O5/c1-2-32-25-13-8-27(6-10(13)18(23)24-31)16-12(21)5-9-15(14(16)22)26(4-3-20)7-11(17(9)28)19(29)30/h5,7,10,31H,2-4,6,8H2,1H3,(H2,23,24)(H,29,30)/b25-13+
    MOLECULAR FORMULA
    C19H20F3N5O5
    CROSS REFERENCES
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    canSAR842232

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 455.14
    AlogP 1.52
    HBond donors 4
    HBond acceptors 10
    Atoms 52
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR842232.