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canSAR781140
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NAMES
    SMILES
    CO/N=C(\C)c1ncn2c1COc1c(CCN3CCN(c4cccc5nc(C)ccc45)CC3)cccc1-2
    InChI
    InChI=1S/C29H32N6O2/c1-20-10-11-23-24(31-20)7-5-8-25(23)34-16-14-33(15-17-34)13-12-22-6-4-9-26-29(22)37-18-27-28(21(2)32-36-3)30-19-35(26)27/h4-11,19H,12-18H2,1-3H3/b32-21+
    MOLECULAR FORMULA
    C29H32N6O2
    CROSS REFERENCES
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    canSAR781140

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 496.26
    AlogP 4.36
    HBond donors 0
    HBond acceptors 8
    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 canSAR781140.