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canSAR782532
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NAMES
    SMILES
    COc1ccc(C(=O)CCCN2CCc3cc(OCc4ccccc4)ccc3C(O)C2)cc1
    InChI
    InChI=1S/C28H31NO4/c1-32-24-11-9-22(10-12-24)27(30)8-5-16-29-17-15-23-18-25(13-14-26(23)28(31)19-29)33-20-21-6-3-2-4-7-21/h2-4,6-7,9-14,18,28,31H,5,8,15-17,19-20H2,1H3
    MOLECULAR FORMULA
    C28H31NO4
    CROSS REFERENCES
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    canSAR782532

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 445.23
    AlogP 4.83
    HBond donors 1
    HBond acceptors 5
    Atoms 64
    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 canSAR782532.