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canSAR1018426
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NAMES
    SMILES
    Cn1c2ccccc2c2cc(C3CC(c4ccc([N+](=O)[O-])cc4)=NN3)ccc21
    InChI
    InChI=1S/C22H18N4O2/c1-25-21-5-3-2-4-17(21)18-12-15(8-11-22(18)25)20-13-19(23-24-20)14-6-9-16(10-7-14)26(27)28/h2-12,20,24H,13H2,1H3
    MOLECULAR FORMULA
    C22H18N4O2
    CROSS REFERENCES
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    canSAR1018426

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 370.14
    AlogP 4.68
    HBond donors 1
    HBond acceptors 6
    Atoms 46
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1018426.