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canSAR1144545
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NAMES
    SMILES
    CNc1nc(C)nc(N2CCC(C(=O)NCc3ccccc3C#N)CC2)n1
    InChI
    InChI=1S/C19H23N7O/c1-13-23-18(21-2)25-19(24-13)26-9-7-14(8-10-26)17(27)22-12-16-6-4-3-5-15(16)11-20/h3-6,14H,7-10,12H2,1-2H3,(H,22,27)(H,21,23,24,25)
    MOLECULAR FORMULA
    C19H23N7O
    CROSS REFERENCES
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    canSAR1144545

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 365.20
    AlogP 1.63
    HBond donors 2
    HBond acceptors 8
    Atoms 50
    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 canSAR1144545.