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canSAR1525123
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NAMES
    SMILES
    CC(=O)NC1CCC(NC(=O)c2cc(-c3ccncc3)n3ncnc(N)c23)CC1
    InChI
    InChI=1S/C20H23N7O2/c1-12(28)25-14-2-4-15(5-3-14)26-20(29)16-10-17(13-6-8-22-9-7-13)27-18(16)19(21)23-11-24-27/h6-11,14-15H,2-5H2,1H3,(H,25,28)(H,26,29)(H2,21,23,24)
    MOLECULAR FORMULA
    C20H23N7O2
    CROSS REFERENCES
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    canSAR1525123

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 393.19
    AlogP 1.55
    HBond donors 4
    HBond acceptors 9
    Atoms 52
    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 canSAR1525123.