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canSAR1766980
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NAMES
    SMILES
    O=C(CN1CCN(CC(=O)Nc2ccccc2F)CC1)Nc1ccc(Cl)c(C(F)(F)F)c1
    InChI
    InChI=1S/C21H21ClF4N4O2/c22-16-6-5-14(11-15(16)21(24,25)26)27-19(31)12-29-7-9-30(10-8-29)13-20(32)28-18-4-2-1-3-17(18)23/h1-6,11H,7-10,12-13H2,(H,27,31)(H,28,32)
    MOLECULAR FORMULA
    C21H21ClF4N4O2
    CROSS REFERENCES
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    canSAR1766980

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 472.13
    AlogP 3.69
    HBond donors 2
    HBond acceptors 6
    Atoms 53
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1766980.