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canSAR398904
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NAMES
    SMILES
    O=C(COc1ccccc1)NC(c1ccccc1)c1cc([N+](=O)[O-])c2cccnc2c1O
    InChI
    InChI=1S/C24H19N3O5/c28-21(15-32-17-10-5-2-6-11-17)26-22(16-8-3-1-4-9-16)19-14-20(27(30)31)18-12-7-13-25-23(18)24(19)29/h1-14,22,29H,15H2,(H,26,28)
    MOLECULAR FORMULA
    C24H19N3O5
    CROSS REFERENCES
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    canSAR398904

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 429.13
    AlogP 4.13
    HBond donors 2
    HBond acceptors 8
    Atoms 51
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR398904.