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canSAR1522447
FEATURES
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NAMES
    SMILES
    COc1cc(N(C)C)c([N+](=O)[O-])cc1C(=O)NC(C)CNc1ccc([N+](=O)[O-])cc1Cl
    InChI
    InChI=1S/C19H22ClN5O6/c1-11(10-21-15-6-5-12(24(27)28)7-14(15)20)22-19(26)13-8-17(25(29)30)16(23(2)3)9-18(13)31-4/h5-9,11,21H,10H2,1-4H3,(H,22,26)
    MOLECULAR FORMULA
    C19H22ClN5O6
    CROSS REFERENCES
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    canSAR1522447

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 451.13
    AlogP 3.46
    HBond donors 2
    HBond acceptors 11
    Atoms 53
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1522447.