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canSAR22764
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NAMES
    SMILES
    Cn1c(COc2ccc(/C=C/C(=O)c3cc(-c4nn[nH]n4)ccc3O)cc2)nc2ccccc21
    InChI
    InChI=1S/C25H20N6O3/c1-31-21-5-3-2-4-20(21)26-24(31)15-34-18-10-6-16(7-11-18)8-12-22(32)19-14-17(9-13-23(19)33)25-27-29-30-28-25/h2-14,33H,15H2,1H3,(H,27,28,29,30)/b12-8+
    MOLECULAR FORMULA
    C25H20N6O3
    CROSS REFERENCES
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    canSAR22764

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 452.16
    AlogP 3.93
    HBond donors 2
    HBond acceptors 9
    Atoms 54
    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 canSAR22764.