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canSAR1121689
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NAMES
    SMILES
    Cc1c(N2CCN(C(=O)Nc3ccc(F)cc3)CC2)c(=O)oc2cc(O)cc(O)c12
    InChI
    InChI=1S/C21H20FN3O5/c1-12-18-16(27)10-15(26)11-17(18)30-20(28)19(12)24-6-8-25(9-7-24)21(29)23-14-4-2-13(22)3-5-14/h2-5,10-11,26-27H,6-9H2,1H3,(H,23,29)
    MOLECULAR FORMULA
    C21H20FN3O5
    CROSS REFERENCES
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    canSAR1121689

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 413.14
    AlogP 3.01
    HBond donors 3
    HBond acceptors 8
    Atoms 50
    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 canSAR1121689.