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canSAR1522075
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NAMES
    SMILES
    Cn1ncc(Cl)c1C(=O)N/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2
    InChI
    InChI=1S/C13H10ClN5O5/c1-18-12(8(14)5-16-18)13(20)17-15-4-7-2-10-11(24-6-23-10)3-9(7)19(21)22/h2-5H,6H2,1H3,(H,17,20)/b15-4+
    MOLECULAR FORMULA
    C13H10ClN5O5
    CROSS REFERENCES
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    canSAR1522075

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 351.04
    AlogP 1.47
    HBond donors 1
    HBond acceptors 10
    Atoms 34
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1522075.