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canSAR1691001
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NAMES
    SMILES
    Brc1cnc(N2CCCC2)nc1N1CCOCC1
    InChI
    InChI=1S/C12H17BrN4O/c13-10-9-14-12(17-3-1-2-4-17)15-11(10)16-5-7-18-8-6-16/h9H,1-8H2
    MOLECULAR FORMULA
    C12H17BrN4O
    CROSS REFERENCES
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    canSAR1691001

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 312.06
    AlogP 1.68
    HBond donors 0
    HBond acceptors 5
    Atoms 35
    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 canSAR1691001.