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canSAR105990
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NAMES
    SMILES
    CN(CC1CCc2nc(N)nc(N)c2C1)c1cccc2ccccc12
    InChI
    InChI=1S/C20H23N5/c1-25(18-8-4-6-14-5-2-3-7-15(14)18)12-13-9-10-17-16(11-13)19(21)24-20(22)23-17/h2-8,13H,9-12H2,1H3,(H4,21,22,23,24)
    MOLECULAR FORMULA
    C20H23N5
    CROSS REFERENCES
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    canSAR105990

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 333.20
    AlogP 3.04
    HBond donors 4
    HBond acceptors 5
    Atoms 48
    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 canSAR105990.