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canSAR1013296
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NAMES
    SMILES
    COc1ccc(-c2ocnc2C(=O)NCc2ccnc(C(F)(F)F)c2)cc1Cl
    InChI
    InChI=1S/C18H13ClF3N3O3/c1-27-13-3-2-11(7-12(13)19)16-15(25-9-28-16)17(26)24-8-10-4-5-23-14(6-10)18(20,21)22/h2-7,9H,8H2,1H3,(H,24,26)
    MOLECULAR FORMULA
    C18H13ClF3N3O3
    CROSS REFERENCES
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    canSAR1013296

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 411.06
    AlogP 4.35
    HBond donors 1
    HBond acceptors 6
    Atoms 41
    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 canSAR1013296.