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canSAR831230
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NAMES
    SMILES
    CN(C)CCCC(O)(c1ccccc1)c1cccc(CCOc2ccc(-c3ccc(C(=O)O)cc3)cc2)c1
    InChI
    InChI=1S/C33H35NO4/c1-34(2)22-7-21-33(37,29-9-4-3-5-10-29)30-11-6-8-25(24-30)20-23-38-31-18-16-27(17-19-31)26-12-14-28(15-13-26)32(35)36/h3-6,8-19,24,37H,7,20-23H2,1-2H3,(H,35,36)
    MOLECULAR FORMULA
    C33H35NO4
    CROSS REFERENCES
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    canSAR831230

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 509.26
    AlogP 6.25
    HBond donors 2
    HBond acceptors 5
    Atoms 73
    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 canSAR831230.