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canSAR670339
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NAMES
    SMILES
    COc1cc2ncc3c(N)nc(-c4cncc(OCCN)c4)cc3c2cc1OC
    InChI
    InChI=1S/C21H21N5O3/c1-27-19-7-15-14-6-17(12-5-13(10-24-9-12)29-4-3-22)26-21(23)16(14)11-25-18(15)8-20(19)28-2/h5-11H,3-4,22H2,1-2H3,(H2,23,26)
    MOLECULAR FORMULA
    C21H21N5O3
    CROSS REFERENCES
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    canSAR670339

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 391.16
    AlogP 2.78
    HBond donors 4
    HBond acceptors 8
    Atoms 50
    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 canSAR670339.