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canSAR1126847
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NAMES
    SMILES
    Cc1cc(N2CCC(CN3CCCC3C)C2)ccc1NC(=O)c1ccc(-n2cccc2)cc1
    InChI
    InChI=1S/C28H34N4O/c1-21-18-26(32-17-13-23(20-32)19-31-16-5-6-22(31)2)11-12-27(21)29-28(33)24-7-9-25(10-8-24)30-14-3-4-15-30/h3-4,7-12,14-15,18,22-23H,5-6,13,16-17,19-20H2,1-2H3,(H,29,33)
    MOLECULAR FORMULA
    C28H34N4O
    CROSS REFERENCES
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    canSAR1126847

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 442.27
    AlogP 5.35
    HBond donors 1
    HBond acceptors 5
    Atoms 67
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1126847.