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canSAR652637
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NAMES
    SMILES
    Cc1cc(C)nc(NCc2ccc(O)c(O)c2)n1
    InChI
    InChI=1S/C13H15N3O2/c1-8-5-9(2)16-13(15-8)14-7-10-3-4-11(17)12(18)6-10/h3-6,17-18H,7H2,1-2H3,(H,14,15,16)
    MOLECULAR FORMULA
    C13H15N3O2
    CROSS REFERENCES
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    canSAR652637

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 245.12
    AlogP 2.12
    HBond donors 3
    HBond acceptors 5
    Atoms 33
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR652637.