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canSAR1490712
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NAMES
    SMILES
    CCOc1cccc(-c2c(C(=O)NN=Cc3ccc(C)o3)nnn2-c2nonc2N)c1
    InChI
    InChI=1S/C19H18N8O4/c1-3-29-13-6-4-5-12(9-13)16-15(22-26-27(16)18-17(20)24-31-25-18)19(28)23-21-10-14-8-7-11(2)30-14/h4-10H,3H2,1-2H3,(H2,20,24)(H,23,28)
    MOLECULAR FORMULA
    C19H18N8O4
    CROSS REFERENCES
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    canSAR1490712

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 422.15
    AlogP 1.96
    HBond donors 3
    HBond acceptors 12
    Atoms 49
    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 canSAR1490712.