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canSAR108732
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NAMES
    SMILES
    COc1cccc2c1ccc1nc3cccc(C(=O)N[C@H](CO)CN(C)C)c3nc12
    InChI
    InChI=1S/C23H24N4O3/c1-27(2)12-14(13-28)24-23(29)17-7-4-8-18-22(17)26-21-16-6-5-9-20(30-3)15(16)10-11-19(21)25-18/h4-11,14,28H,12-13H2,1-3H3,(H,24,29)/t14-/m0/s1
    MOLECULAR FORMULA
    C23H24N4O3
    CROSS REFERENCES
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    canSAR108732

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 404.18
    AlogP 2.60
    HBond donors 2
    HBond acceptors 7
    Atoms 54
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR108732.