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canSAR1012758
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NAMES
    SMILES
    OCCNc1cc(C(F)F)nc(-c2ccc(Br)cc2)n1
    InChI
    InChI=1S/C13H12BrF2N3O/c14-9-3-1-8(2-4-9)13-18-10(12(15)16)7-11(19-13)17-5-6-20/h1-4,7,12,20H,5-6H2,(H,17,18,19)
    MOLECULAR FORMULA
    C13H12BrF2N3O
    CROSS REFERENCES
    1012758 logo

    canSAR1012758

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 343.01
    AlogP 3.25
    HBond donors 2
    HBond acceptors 4
    Atoms 32
    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 canSAR1012758.