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canSAR546355
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NAMES
    SMILES
    CN(C)CCNCCNc1ccc2c3c(nn2CCCN)-c2c(O)ccc(O)c2C(=O)c13
    InChI
    InChI=1S/C23H30N6O3/c1-28(2)13-11-25-9-10-26-14-4-5-15-19-18(14)23(32)21-17(31)7-6-16(30)20(21)22(19)27-29(15)12-3-8-24/h4-7,25-26,30-31H,3,8-13,24H2,1-2H3
    MOLECULAR FORMULA
    C23H30N6O3
    CROSS REFERENCES
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    canSAR546355

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 438.24
    AlogP 1.57
    HBond donors 6
    HBond acceptors 9
    Atoms 62
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR546355.