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canSAR2053212
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NAMES
    SMILES
    CCCn1c(Br)nc2c(N)nc(NCCc3ccccc3)nc21
    InChI
    InChI=1S/C16H19BrN6/c1-2-10-23-14-12(20-15(23)17)13(18)21-16(22-14)19-9-8-11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3,(H3,18,19,21,22)
    MOLECULAR FORMULA
    C16H19BrN6
    CROSS REFERENCES
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    canSAR2053212

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 374.09
    AlogP 3.24
    HBond donors 3
    HBond acceptors 6
    Atoms 42
    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 canSAR2053212.