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canSAR1405043
FEATURES
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NAMES
    SMILES
    C=C(CF)C(=O)Nc1cccc(-c2ncnc3[nH]cc(C(=O)OCC)c23)c1
    InChI
    InChI=1S/C19H17FN4O3/c1-3-27-19(26)14-9-21-17-15(14)16(22-10-23-17)12-5-4-6-13(7-12)24-18(25)11(2)8-20/h4-7,9-10H,2-3,8H2,1H3,(H,24,25)(H,21,22,23)
    MOLECULAR FORMULA
    C19H17FN4O3
    CROSS REFERENCES
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    canSAR1405043

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 368.13
    AlogP 3.27
    HBond donors 2
    HBond acceptors 7
    Atoms 44
    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 canSAR1405043.