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canSAR113010
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NAMES
    SMILES
    CCCc1cc(OCCN(C)C)cc(=O)n1Cc1ccc(-c2ccccc2-c2nn[nH]n2)cc1
    InChI
    InChI=1S/C26H30N6O2/c1-4-7-21-16-22(34-15-14-31(2)3)17-25(33)32(21)18-19-10-12-20(13-11-19)23-8-5-6-9-24(23)26-27-29-30-28-26/h5-6,8-13,16-17H,4,7,14-15,18H2,1-3H3,(H,27,28,29,30)
    MOLECULAR FORMULA
    C26H30N6O2
    CROSS REFERENCES
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    canSAR113010

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 458.24
    AlogP 3.64
    HBond donors 1
    HBond acceptors 8
    Atoms 64
    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 canSAR113010.