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canSAR1012518
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NAMES
    SMILES
    CC(C)n1c(NC(=O)c2ccc3cc4n(c3c2)CCCNC4=O)nc2ccccc21
    InChI
    InChI=1S/C23H23N5O2/c1-14(2)28-18-7-4-3-6-17(18)25-23(28)26-21(29)16-9-8-15-12-20-22(30)24-10-5-11-27(20)19(15)13-16/h3-4,6-9,12-14H,5,10-11H2,1-2H3,(H,24,30)(H,25,26,29)
    MOLECULAR FORMULA
    C23H23N5O2
    CROSS REFERENCES
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    canSAR1012518

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 401.19
    AlogP 3.96
    HBond donors 2
    HBond acceptors 7
    Atoms 53
    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 canSAR1012518.