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canSAR1621486
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NAMES
    SMILES
    CNC(=O)Oc1cccc(CN(C)CCCCCCCOc2ccc3c(c2)OC(=Cc2cccc4ccccc24)C3=O)c1
    InChI
    InChI=1S/C36H38N2O5/c1-37-36(40)42-30-16-10-12-26(22-30)25-38(2)20-8-4-3-5-9-21-41-29-18-19-32-33(24-29)43-34(35(32)39)23-28-15-11-14-27-13-6-7-17-31(27)28/h6-7,10-19,22-24H,3-5,8-9,20-21,25H2,1-2H3,(H,37,40)
    MOLECULAR FORMULA
    C36H38N2O5
    CROSS REFERENCES
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    canSAR1621486

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 578.28
    AlogP 7.64
    HBond donors 1
    HBond acceptors 7
    Atoms 81
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1621486.