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canSAR463706
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NAMES
    SMILES
    CC1(C)CCC(C)(C)c2cc(C(O)c3ccc4cc(C(=O)O)ccc4c3)ccc21
    InChI
    InChI=1S/C26H28O3/c1-25(2)11-12-26(3,4)22-15-19(9-10-21(22)25)23(27)18-7-5-17-14-20(24(28)29)8-6-16(17)13-18/h5-10,13-15,23,27H,11-12H2,1-4H3,(H,28,29)
    MOLECULAR FORMULA
    C26H28O3
    CROSS REFERENCES
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    canSAR463706

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 388.20
    AlogP 5.97
    HBond donors 2
    HBond acceptors 3
    Atoms 57
    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 canSAR463706.