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canSAR1154268
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NAMES
    SMILES
    CC1CN(c2ccc3c(=O)c(C(=O)O)cn(-c4c(F)cccc4F)c3c2)CCN1
    InChI
    InChI=1S/C21H19F2N3O3/c1-12-10-25(8-7-24-12)13-5-6-14-18(9-13)26(11-15(20(14)27)21(28)29)19-16(22)3-2-4-17(19)23/h2-6,9,11-12,24H,7-8,10H2,1H3,(H,28,29)
    MOLECULAR FORMULA
    C21H19F2N3O3
    CROSS REFERENCES
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    canSAR1154268

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 399.14
    AlogP 2.77
    HBond donors 2
    HBond acceptors 6
    Atoms 48
    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 canSAR1154268.