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canSAR551979
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NAMES
    SMILES
    O=C([O-])CCC/N=C(\c1ccc(Cl)cc1)c1cc(F)ccc1O.[Na+]
    InChI
    InChI=1S/C17H15ClFNO3.Na/c18-12-5-3-11(4-6-12)17(20-9-1-2-16(22)23)14-10-13(19)7-8-15(14)21;/h3-8,10,21H,1-2,9H2,(H,22,23);/q;+1/p-1/b20-17+;
    MOLECULAR FORMULA
    C17H14ClFNNaO3
    CROSS REFERENCES
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    canSAR551979

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 357.05
    AlogP -0.44
    HBond donors 1
    HBond acceptors 4
    Atoms 38
    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 canSAR551979.