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canSAR1689891
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NAMES
    SMILES
    COc1ccc(OC)c(NC(=O)c2cc(-c3ccc(F)cc3OC(C)C)[nH]n2)c1
    InChI
    InChI=1S/C21H22FN3O4/c1-12(2)29-20-9-13(22)5-7-15(20)16-11-18(25-24-16)21(26)23-17-10-14(27-3)6-8-19(17)28-4/h5-12H,1-4H3,(H,23,26)(H,24,25)
    MOLECULAR FORMULA
    C21H22FN3O4
    CROSS REFERENCES
    1689891 logo

    canSAR1689891

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 399.16
    AlogP 4.27
    HBond donors 2
    HBond acceptors 7
    Atoms 51
    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 canSAR1689891.