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canSAR671427
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NAMES
    SMILES
    O=C1c2cccc3cccc(c23)C(=O)N1CC1CCN(CC(O)COc2cccc3[nH]c4ccccc4c23)CC1
    InChI
    InChI=1S/C33H31N3O4/c37-23(20-40-29-13-5-12-28-31(29)24-8-1-2-11-27(24)34-28)19-35-16-14-21(15-17-35)18-36-32(38)25-9-3-6-22-7-4-10-26(30(22)25)33(36)39/h1-13,21,23,34,37H,14-20H2
    MOLECULAR FORMULA
    C33H31N3O4
    CROSS REFERENCES
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    canSAR671427

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 533.23
    AlogP 5.22
    HBond donors 2
    HBond acceptors 7
    Atoms 71
    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 canSAR671427.