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canSAR830405
FEATURES
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NAMES
    SMILES
    CC(=O)N[C@@H]1[C@@H](n2cc(-c3ccc(F)cc3)nn2)C=C(C(=O)O)O[C@H]1[C@H](O)[C@H](O)CO
    InChI
    InChI=1S/C19H21FN4O7/c1-9(26)21-16-13(6-15(19(29)30)31-18(16)17(28)14(27)8-25)24-7-12(22-23-24)10-2-4-11(20)5-3-10/h2-7,13-14,16-18,25,27-28H,8H2,1H3,(H,21,26)(H,29,30)/t13-,14+,16+,17+,18+/m0/s1
    MOLECULAR FORMULA
    C19H21FN4O7
    CROSS REFERENCES
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    canSAR830405

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 436.14
    AlogP -0.79
    HBond donors 5
    HBond acceptors 11
    Atoms 52
    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 canSAR830405.