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canSAR67093
FEATURES
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NAMES
    SMILES
    N=C(N)c1ccc2[nH]c(-c3cc(CCOP(=O)(O)O)cc(-c4cccc([N+](=O)[O-])c4)c3O)cc2c1
    InChI
    InChI=1S/C23H21N4O7P/c24-23(25)15-4-5-20-16(10-15)12-21(26-20)19-9-13(6-7-34-35(31,32)33)8-18(22(19)28)14-2-1-3-17(11-14)27(29)30/h1-5,8-12,26,28H,6-7H2,(H3,24,25)(H2,31,32,33)
    MOLECULAR FORMULA
    C23H21N4O7P
    CROSS REFERENCES
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    canSAR67093

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 496.11
    AlogP 4.05
    HBond donors 7
    HBond acceptors 11
    Atoms 56
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR67093.