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canSAR672219
FEATURES
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NAMES
    SMILES
    Cc1cc2oc(=O)cc(CN=[N+]=[N-])c2cc1S(=O)(=O)Nc1cc([N+](=O)[O-])ccc1Cl
    InChI
    InChI=1S/C17H12ClN5O6S/c1-9-4-15-12(10(8-20-22-19)5-17(24)29-15)7-16(9)30(27,28)21-14-6-11(23(25)26)2-3-13(14)18/h2-7,21H,8H2,1H3
    MOLECULAR FORMULA
    C17H12ClN5O6S
    CROSS REFERENCES
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    canSAR672219

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 449.02
    AlogP 4.27
    HBond donors 1
    HBond acceptors 11
    Atoms 42
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR672219.