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canSAR1969639
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NAMES
    SMILES
    CCOC(=O)c1cc(-c2ccccc2)n(-c2cccc(C(=O)Nc3cccc(F)c3)c2)c1C
    InChI
    InChI=1S/C27H23FN2O3/c1-3-33-27(32)24-17-25(19-9-5-4-6-10-19)30(18(24)2)23-14-7-11-20(15-23)26(31)29-22-13-8-12-21(28)16-22/h4-17H,3H2,1-2H3,(H,29,31)
    MOLECULAR FORMULA
    C27H23FN2O3
    CROSS REFERENCES
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    canSAR1969639

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 442.17
    AlogP 6.02
    HBond donors 1
    HBond acceptors 5
    Atoms 56
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1969639.