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canSAR1129418
FEATURES
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NAMES
    SMILES
    COc1cc(/C=C2\OC(=O)C(c3ccc(F)cc3)=C2c2ccc(S(C)(=O)=O)cc2)ccc1O
    InChI
    InChI=1S/C25H19FO6S/c1-31-21-13-15(3-12-20(21)27)14-22-23(16-6-10-19(11-7-16)33(2,29)30)24(25(28)32-22)17-4-8-18(26)9-5-17/h3-14,27H,1-2H3/b22-14-
    MOLECULAR FORMULA
    C25H19FO6S
    CROSS REFERENCES
    1129418 logo

    canSAR1129418

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 466.09
    AlogP 4.45
    HBond donors 1
    HBond acceptors 6
    Atoms 52
    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 canSAR1129418.