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canSAR1403640
FEATURES
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NAMES
    SMILES
    COCCNC[C@@H](NC(=O)N1CCc2cnc(NC(C)C)nc2C1)c1ccc(F)c(Cl)c1
    InChI
    InChI=1S/C22H30ClFN6O2/c1-14(2)27-21-26-11-16-6-8-30(13-20(16)28-21)22(31)29-19(12-25-7-9-32-3)15-4-5-18(24)17(23)10-15/h4-5,10-11,14,19,25H,6-9,12-13H2,1-3H3,(H,29,31)(H,26,27,28)/t19-/m1/s1
    MOLECULAR FORMULA
    C22H30ClFN6O2
    CROSS REFERENCES
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    canSAR1403640

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 464.21
    AlogP 3.13
    HBond donors 3
    HBond acceptors 8
    Atoms 62
    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 canSAR1403640.