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canSAR1091720
FEATURES
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NAMES
    SMILES
    CCN1CCN(c2cc3c(cc2F)c(=O)c(C(=O)O)cn3C2CC2)CC1C(=O)O
    InChI
    InChI=1S/C20H22FN3O5/c1-2-22-5-6-23(10-17(22)20(28)29)16-8-15-12(7-14(16)21)18(25)13(19(26)27)9-24(15)11-3-4-11/h7-9,11,17H,2-6,10H2,1H3,(H,26,27)(H,28,29)
    MOLECULAR FORMULA
    C20H22FN3O5
    CROSS REFERENCES
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    canSAR1091720

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 403.15
    AlogP 1.77
    HBond donors 2
    HBond acceptors 8
    Atoms 51
    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 canSAR1091720.