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canSAR1271404
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NAMES
    SMILES
    CN(C)CCN(C)c1nc2c(c(Nc3cc(C4CC4)[nH]n3)n1)CCC2
    InChI
    InChI=1S/C18H27N7/c1-24(2)9-10-25(3)18-19-14-6-4-5-13(14)17(21-18)20-16-11-15(22-23-16)12-7-8-12/h11-12H,4-10H2,1-3H3,(H2,19,20,21,22,23)
    MOLECULAR FORMULA
    C18H27N7
    CROSS REFERENCES
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    canSAR1271404

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 341.23
    AlogP 2.31
    HBond donors 2
    HBond acceptors 7
    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 canSAR1271404.