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canSAR1128646
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NAMES
    SMILES
    CCN(CC)CCC(=O)Nc1ccccc1-c1nc(NCCCN(C)C)c2ccccc2n1
    InChI
    InChI=1S/C26H36N6O/c1-5-32(6-2)19-16-24(33)28-22-14-9-8-13-21(22)26-29-23-15-10-7-12-20(23)25(30-26)27-17-11-18-31(3)4/h7-10,12-15H,5-6,11,16-19H2,1-4H3,(H,28,33)(H,27,29,30)
    MOLECULAR FORMULA
    C26H36N6O
    CROSS REFERENCES
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    canSAR1128646

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 448.30
    AlogP 4.33
    HBond donors 2
    HBond acceptors 7
    Atoms 69
    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 canSAR1128646.