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canSAR1016122
FEATURES
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NAMES
    SMILES
    O=C(N/N=C/c1cc(F)ccc1O)c1cnc2c(C(F)(F)F)cccc2c1O
    InChI
    InChI=1S/C18H11F4N3O3/c19-10-4-5-14(26)9(6-10)7-24-25-17(28)12-8-23-15-11(16(12)27)2-1-3-13(15)18(20,21)22/h1-8,26H,(H,23,27)(H,25,28)/b24-7+
    MOLECULAR FORMULA
    C18H11F4N3O3
    CROSS REFERENCES
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    canSAR1016122

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 393.07
    AlogP 3.57
    HBond donors 3
    HBond acceptors 6
    Atoms 39
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1016122.