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canSAR1588036
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NAMES
    SMILES
    CC(=O)NC(C)Cc1ccc(C2CN(c3ncc(Br)cn3)C2)cc1
    InChI
    InChI=1S/C18H21BrN4O/c1-12(22-13(2)24)7-14-3-5-15(6-4-14)16-10-23(11-16)18-20-8-17(19)9-21-18/h3-6,8-9,12,16H,7,10-11H2,1-2H3,(H,22,24)
    MOLECULAR FORMULA
    C18H21BrN4O
    CROSS REFERENCES
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    canSAR1588036

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 388.09
    AlogP 2.91
    HBond donors 1
    HBond acceptors 5
    Atoms 45
    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 canSAR1588036.