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canSAR1127853
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NAMES
    SMILES
    CNc1nc(NC)nc(N2CCC(C(=O)NCc3ccccc3C(F)(F)F)CC2)n1
    InChI
    InChI=1S/C19H24F3N7O/c1-23-16-26-17(24-2)28-18(27-16)29-9-7-12(8-10-29)15(30)25-11-13-5-3-4-6-14(13)19(20,21)22/h3-6,12H,7-11H2,1-2H3,(H,25,30)(H2,23,24,26,27,28)
    MOLECULAR FORMULA
    C19H24F3N7O
    CROSS REFERENCES
    1127853 logo

    canSAR1127853

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 423.20
    AlogP 2.51
    HBond donors 3
    HBond acceptors 8
    Atoms 54
    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 canSAR1127853.