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canSAR1963720
FEATURES
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NAMES
    SMILES
    Cc1cccc2c(=O)c3cccc([C@H](C)C(=O)O)c3oc12.[Na+]
    InChI
    InChI=1S/C17H14O4.Na/c1-9-5-3-7-12-14(18)13-8-4-6-11(10(2)17(19)20)16(13)21-15(9)12;/h3-8,10H,1-2H3,(H,19,20);/q;+1/t10-;/m0./s1
    MOLECULAR FORMULA
    C17H14NaO4+
    CROSS REFERENCES
    1963720 logo

    canSAR1963720

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 305.08
    AlogP 0.45
    HBond donors 1
    HBond acceptors 4
    Atoms 36
    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 canSAR1963720.