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canSAR111730
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NAMES
    SMILES
    COc1cc(OC)cc(C(=O)Oc2ccc3c(c2)C(C)=CC(C)(C)N3Cc2ccc(C)cc2)c1
    InChI
    InChI=1S/C29H31NO4/c1-19-7-9-21(10-8-19)18-30-27-12-11-23(16-26(27)20(2)17-29(30,3)4)34-28(31)22-13-24(32-5)15-25(14-22)33-6/h7-17H,18H2,1-6H3
    MOLECULAR FORMULA
    C29H31NO4
    CROSS REFERENCES
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    canSAR111730

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 457.23
    AlogP 6.43
    HBond donors 0
    HBond acceptors 5
    Atoms 65
    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 canSAR111730.