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canSAR396239
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NAMES
    SMILES
    COC[C@H](C)Nc1nccc(-c2c(-c3ccc(F)cc3)c(=O)n3n2CCCC3)n1
    InChI
    InChI=1S/C21H24FN5O2/c1-14(13-29-2)24-21-23-10-9-17(25-21)19-18(15-5-7-16(22)8-6-15)20(28)27-12-4-3-11-26(19)27/h5-10,14H,3-4,11-13H2,1-2H3,(H,23,24,25)/t14-/m0/s1
    MOLECULAR FORMULA
    C21H24FN5O2
    CROSS REFERENCES
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    canSAR396239

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 397.19
    AlogP 3.15
    HBond donors 1
    HBond acceptors 7
    Atoms 53
    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 canSAR396239.