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canSAR1596488
FEATURES
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NAMES
    SMILES
    CCOc1cc([C@@H]2NC(=O)NC(c3ccccc3)=C2c2ccccc2)cc([N+](=O)[O-])c1O
    InChI
    InChI=1S/C24H21N3O5/c1-2-32-19-14-17(13-18(23(19)28)27(30)31)22-20(15-9-5-3-6-10-15)21(25-24(29)26-22)16-11-7-4-8-12-16/h3-14,22,28H,2H2,1H3,(H2,25,26,29)/t22-/m0/s1
    MOLECULAR FORMULA
    C24H21N3O5
    CROSS REFERENCES
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    canSAR1596488

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 431.15
    AlogP 4.62
    HBond donors 3
    HBond acceptors 8
    Atoms 53
    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 canSAR1596488.