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canSAR501676
FEATURES
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NAMES
    SMILES
    CC1COc2c(N3CCn4cc(C(=O)O)nc4C3)c(F)c([N+](=O)[O-])c3c(=O)c(C(=O)O)cn1c23
    InChI
    InChI=1S/C20H16FN5O8/c1-8-7-34-18-15-12(17(27)9(19(28)29)4-25(8)15)14(26(32)33)13(21)16(18)24-3-2-23-5-10(20(30)31)22-11(23)6-24/h4-5,8H,2-3,6-7H2,1H3,(H,28,29)(H,30,31)
    MOLECULAR FORMULA
    C20H16FN5O8
    CROSS REFERENCES
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    canSAR501676

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 473.10
    AlogP 1.62
    HBond donors 2
    HBond acceptors 13
    Atoms 50
    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 canSAR501676.