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canSAR986517
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NAMES
    SMILES
    COc1cccc(-c2nc(NN)n(C)c(=O)c2C#N)c1OC
    InChI
    InChI=1S/C14H15N5O3/c1-19-13(20)9(7-15)11(17-14(19)18-16)8-5-4-6-10(21-2)12(8)22-3/h4-6H,16H2,1-3H3,(H,17,18)
    MOLECULAR FORMULA
    C14H15N5O3
    CROSS REFERENCES
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    canSAR986517

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 301.12
    AlogP 0.62
    HBond donors 3
    HBond acceptors 8
    Atoms 37
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR986517.