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canSAR1861911
FEATURES
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NAMES
    SMILES
    O=C(CCC(=O)OCC(=O)c1cccc([N+](=O)[O-])c1)Nc1cccc(Cl)c1Cl
    InChI
    InChI=1S/C18H14Cl2N2O6/c19-13-5-2-6-14(18(13)20)21-16(24)7-8-17(25)28-10-15(23)11-3-1-4-12(9-11)22(26)27/h1-6,9H,7-8,10H2,(H,21,24)
    MOLECULAR FORMULA
    C18H14Cl2N2O6
    CROSS REFERENCES
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    canSAR1861911

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 424.02
    AlogP 4.05
    HBond donors 1
    HBond acceptors 8
    Atoms 42
    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 canSAR1861911.