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canSAR552978
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NAMES
    SMILES
    COc1ccc(CNc2nnc(N3CCC(C)(O)CC3)c3ccc(C#N)cc23)cc1Cl
    InChI
    InChI=1S/C23H24ClN5O2/c1-23(30)7-9-29(10-8-23)22-17-5-3-15(13-25)11-18(17)21(27-28-22)26-14-16-4-6-20(31-2)19(24)12-16/h3-6,11-12,30H,7-10,14H2,1-2H3,(H,26,27)
    MOLECULAR FORMULA
    C23H24ClN5O2
    CROSS REFERENCES
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    canSAR552978

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 437.16
    AlogP 4.13
    HBond donors 2
    HBond acceptors 7
    Atoms 55
    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 canSAR552978.