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canSAR1523918
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NAMES
    SMILES
    Cc1ccc(-n2nc3ccc(NC(=O)c4cccc([N+](=O)[O-])c4C)cc3n2)cc1
    InChI
    InChI=1S/C21H17N5O3/c1-13-6-9-16(10-7-13)25-23-18-11-8-15(12-19(18)24-25)22-21(27)17-4-3-5-20(14(17)2)26(28)29/h3-12H,1-2H3,(H,22,27)
    MOLECULAR FORMULA
    C21H17N5O3
    CROSS REFERENCES
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    canSAR1523918

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 387.13
    AlogP 4.20
    HBond donors 1
    HBond acceptors 8
    Atoms 46
    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 canSAR1523918.