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canSAR1019478
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NAMES
    SMILES
    CCN1CCC(Nc2ccc3c(c2)C(=C(c2cccc(F)c2)c2ncc[nH]2)C(=O)N3)CC1
    InChI
    InChI=1S/C25H26FN5O/c1-2-31-12-8-18(9-13-31)29-19-6-7-21-20(15-19)23(25(32)30-21)22(24-27-10-11-28-24)16-4-3-5-17(26)14-16/h3-7,10-11,14-15,18,29H,2,8-9,12-13H2,1H3,(H,27,28)(H,30,32)
    MOLECULAR FORMULA
    C25H26FN5O
    CROSS REFERENCES
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    canSAR1019478

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 431.21
    AlogP 4.36
    HBond donors 3
    HBond acceptors 6
    Atoms 58
    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 canSAR1019478.