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canSAR2017039
FEATURES
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NAMES
    SMILES
    O=[N+]([O-])c1ccc(-n2c(O)c3c(c2O)[C@@H]2CC[C@H]3C2)cc1C(F)(F)F
    InChI
    InChI=1S/C16H13F3N2O4/c17-16(18,19)10-6-9(3-4-11(10)21(24)25)20-14(22)12-7-1-2-8(5-7)13(12)15(20)23/h3-4,6-8,22-23H,1-2,5H2/t7-,8+
    MOLECULAR FORMULA
    C16H13F3N2O4
    CROSS REFERENCES
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    canSAR2017039

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 354.08
    AlogP 4.18
    HBond donors 2
    HBond acceptors 6
    Atoms 38
    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 canSAR2017039.