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canSAR201576
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NAMES
    SMILES
    CCN(CC)Cc1nn(-c2ccc(F)cc2)c2c1CCCC2Cc1cccc2ccccc12
    InChI
    InChI=1S/C29H32FN3/c1-3-32(4-2)20-28-27-14-8-12-23(19-22-11-7-10-21-9-5-6-13-26(21)22)29(27)33(31-28)25-17-15-24(30)16-18-25/h5-7,9-11,13,15-18,23H,3-4,8,12,14,19-20H2,1-2H3
    MOLECULAR FORMULA
    C29H32FN3
    CROSS REFERENCES
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    canSAR201576

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 441.26
    AlogP 6.67
    HBond donors 0
    HBond acceptors 3
    Atoms 65
    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 canSAR201576.